Datasets:
Anonymous-07
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SafeChem

Dataset card Data Studio Files
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primary_name
string
cas_number
string
cid
int64
iupac_name
string
canonical_smiles
string
inchi
string
inchi_key
string
molecular_formula
string
molecular_weight
float64
exact_mass
float64
xlogp
float64
tpsa
float64
complexity
int64
charge
int64
h_bond_donor_count
int64
h_bond_acceptor_count
int64
rotatable_bond_count
int64
heavy_atom_count
int64
flash_point
string
boiling_point
string
acute_aquatic_toxicity
int64
acute_toxicity_dermal
int64
acute_toxicity_inhalation
int64
acute_toxicity_oral
int64
aspiration_hazard
int64
carcinogenicity
int64
chronic_aquatic_toxicity
int64
eye_damage_irritation
int64
flammable_liquids
int64
flammable_solids
int64
germ_cell_mutagenicity
int64
metal_corrosion
int64
organic_peroxides
int64
reproductive_toxicity
int64
respiratory_sensitization
int64
self_reactive_substances
int64
skin_corrosion_irritation
int64
skin_sensitization
int64
stot_repeated_exposure
int64
stot_single_exposure
int64
ERBIUM (III) NITRATE
010168-80-6
159,265
erbium(3+) trinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Er+3]
InChI=1S/Er.3NO3/c;3*2-1(3)4/q+3;3*-1
YBYGDBANBWOYIF-UHFFFAOYSA-N
ErN3O9
353.27
351.893755
null
189
18
0
0
9
0
13
null
null
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
1
HYDRAZINECARBOXIMIDAMIDE, MONONITRATE
010308-82-4
165,859
2-aminoguanidine;nitric acid
C(=NN)(N)N.[N+](=O)(O)[O-]
InChI=1S/CH6N4.HNO3/c2-1(3)5-4;2-1(3)4/h4H2,(H4,2,3,5);(H,2,3,4)
PMGFHEJUUBDCLU-UHFFFAOYSA-N
CH7N5O3
137.1
137.054889
null
156
66
0
4
5
0
9
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
MAGNESIUM NITRATE
010377-60-3
25,212
magnesium dinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Mg+2]
InChI=1S/Mg.2NO3/c;2*2-1(3)4/q+2;2*-1
YIXJRHPUWRPCBB-UHFFFAOYSA-N
MgN2O6
148.32
147.960677
null
126
18
0
0
6
0
9
null
Decomposes at 626 °F (USCG, 1999)
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
PALLADIUM DIHYDROXIDE
012135-22-7
9,942,167
palladium(2+) dihydroxide
[OH-].[OH-].[Pd+2]
InChI=1S/2H2O.Pd/h2*1H2;/q;;+2/p-2
NXJCBFBQEVOTOW-UHFFFAOYSA-L
H2O2Pd
140.43
139.90896
null
2
0
0
2
2
0
3
null
null
0
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
0
1
0
0
BERYLLIUM NITRATE
013597-99-4
26,126
beryllium dinitrate
[Be+2].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]
InChI=1S/Be.2NO3/c;2*2-1(3)4/q+2;2*-1
RFVVBBUVWAIIBT-UHFFFAOYSA-N
BeN2O6
133.02
132.987819
null
126
18
0
0
6
0
9
null
null
0
0
1
1
0
1
1
1
0
0
0
0
0
0
1
0
1
1
1
1
ZIRCONIUM NITRATE
013746-89-9
26,251
zirconium(4+) tetranitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Zr+4]
InChI=1S/4NO3.Zr/c4*2-1(3)4;/q4*-1;+4
OERNJTNJEZOPIA-UHFFFAOYSA-N
N4O12Zr
339.24
337.85597
null
252
18
0
0
12
0
17
null
Decomposes at 100 °C
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
0
PERCHLORIC ACID, LANTHANUM(3+) SALT
014017-46-0
166,977
lanthanum(3+) triperchlorate
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[La+3]
InChI=1S/3ClHO4.La/c3*2-1(3,4)5;/h3*(H,2,3,4,5);/q;;;+3/p-3
MYGVQOYLIMJKKU-UHFFFAOYSA-K
Cl3LaO12
437.25
435.751896
null
223
95
0
0
12
0
16
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
0
NEODYMIUM(III) NITRATE HYDRATE
013746-96-8
71,311,426
neodymium(3+);trinitrate;hydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.[Nd+3]
InChI=1S/3NO3.Nd.H2O/c3*2-1(3)4;;/h;;;;1H2/q3*-1;+3;
GZIAUVGSMHERLN-UHFFFAOYSA-N
H2N3NdO10
348.27
345.88175
null
190
18
0
1
10
0
14
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
LUTETIUM(III) NITRATE HYDRATE
100641-16-5
16,212,852
lutetium(3+);trinitrate;hydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.[Lu+3]
InChI=1S/Lu.3NO3.H2O/c;3*2-1(3)4;/h;;;;1H2/q+3;3*-1;
XZBUOUZGWUJJES-UHFFFAOYSA-N
H2LuN3O10
379
378.9148
null
190
18
0
1
10
0
14
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
MANGANESE(II) PERCHLORATE HYDRATE
698999-57-4
53,470,804
manganese(2+);diperchlorate;hydrate
O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Mn+2]
InChI=1S/2ClHO4.Mn.H2O/c2*2-1(3,4)5;;/h2*(H,2,3,4,5);;1H2/q;;+2;/p-2
VAZHKDVMMUBWIG-UHFFFAOYSA-L
Cl2H2MnO9
271.85
270.84563
null
150
95
0
1
9
0
12
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
TETRABUTYLAMMONIUM, SALT WITH CHROMIC ACID (2:1)
056660-19-6
6,453,374
dioxido(dioxo)chromium;bis(tetrabutylazanium)
CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.[O-][Cr](=O)(=O)[O-]
InChI=1S/2C16H36N.Cr.4O/c2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;;/h2*5-16H2,1-4H3;;;;;/q2*+1;;;;2*-1
ZWQUOQAMKSRLDH-UHFFFAOYSA-N
C32H72CrN2O4
600.9
600.489713
null
80.3
178
0
0
4
24
39
null
null
1
0
0
0
0
1
1
0
0
0
0
0
0
0
0
0
0
1
0
0
MERCURY(II) PERCHLORATE HYDRATE
304656-34-6
57,376,986
mercury(2+);diperchlorate;hydrate
O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Hg+2]
InChI=1S/2ClHO4.Hg.H2O/c2*2-1(3,4)5;;/h2*(H,2,3,4,5);;1H2/q;;+2;/p-2
OOYSCVKOXPZTGW-UHFFFAOYSA-L
Cl2H2HgO9
417.51
417.878231
null
150
95
0
1
9
0
12
null
null
1
1
1
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
1
1
LITHIUM PERIODATE
021111-84-2
23,711,816
lithium periodate
[Li+].[O-]I(=O)(=O)=O
InChI=1S/HIO4.Li/c2-1(3,4)5;/h(H,2,3,4,5);/q;+1/p-1
SYWXNZXEJFSLEU-UHFFFAOYSA-M
ILiO4
197.9
197.90013
null
74.3
118
0
0
4
0
6
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
INDIUM(III) PERCHLORATE OCTAHYDRATE
013465-15-1
91,886,280
indium(3+);triperchlorate;octahydrate
O.O.O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[In+3]
InChI=1S/3ClHO4.In.8H2O/c3*2-1(3,4)5;;;;;;;;;/h3*(H,2,3,4,5);;8*1H2/q;;;+3;;;;;;;;/p-3
XTGOEFBXGBSXJW-UHFFFAOYSA-K
Cl3H16InO20
557.3
555.83393
null
231
95
0
8
20
0
24
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
AMMONIUM NITRATE (15N2, 98%+)
043086-60-8
71,309,570
null
[15NH3].[15N+](=O)(O)[O-]
InChI=1S/HNO3.H3N/c2-1(3)4;/h(H,2,3,4);1H3/i2*1+1
PRORZGWHZXZQMV-NPMJFZSBSA-N
H4N2O3
82.03
82.016262
null
67.1
24
0
2
4
0
5
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
DYSPROSIUM(III) NITRATE HYDRATE
100641-13-2
57,346,095
dysprosium(3+);trinitrate;hydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.[Dy+3]
InChI=1S/Dy.3NO3.H2O/c;3*2-1(3)4;/h;;;;1H2/q+3;3*-1;
DSEBQRTVZFLVND-UHFFFAOYSA-N
DyH2N3O10
366.53
367.903199
null
190
18
0
1
10
0
14
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
STRONTIUM PERCHLORATE TRIHYDRATE
015650-09-6
71,435,311
strontium;diperchlorate;trihydrate
O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Sr+2]
InChI=1S/2ClHO4.3H2O.Sr/c2*2-1(3,4)5;;;;/h2*(H,2,3,4,5);3*1H2;/q;;;;;+2/p-2
VRRVWIQWZWFYDJ-UHFFFAOYSA-L
Cl2H6O11Sr
340.56
339.834329
null
152
95
0
3
11
0
14
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
ETHANAMINIUM, N,N,N-TRIETHYL-, NITRATE
001941-26-0
74,744
tetraethylazanium nitrate
CC[N+](CC)(CC)CC.[N+](=O)([O-])[O-]
InChI=1S/C8H20N.NO3/c1-5-9(6-2,7-3)8-4;2-1(3)4/h5-8H2,1-4H3;/q+1;-1
JTJKNAJRGLQKDZ-UHFFFAOYSA-N
C8H20N2O3
192.26
192.147393
null
62.9
66
0
0
3
4
13
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
PERCHLORIC ACID, MERCURY(2+) SALT
007616-83-3
3,080,641
mercury(2+) diperchlorate
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Hg+2]
InChI=1S/2ClHO4.Hg/c2*2-1(3,4)5;/h2*(H,2,3,4,5);/q;;+2/p-2
KBYOBAICCHNMNJ-UHFFFAOYSA-L
Cl2HgO8
399.49
399.867666
null
149
95
0
0
8
0
11
null
null
1
1
1
1
0
0
1
0
0
0
0
0
0
0
0
0
0
0
1
0
MANGANIC ACID (H2MNO4), BARIUM SALT (1:1)
007787-35-1
3,084,030
barium(2+);dioxido(dioxo)manganese
[O-][Mn](=O)(=O)[O-].[Ba+2]
InChI=1S/Ba.Mn.4O/q+2;;;;2*-1
ZZCNKSMCIZCVDR-UHFFFAOYSA-N
BaMnO4
256.26
256.822949
null
80.3
62
0
0
4
0
6
null
null
0
0
1
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
SODIUM HYPOCHLORITE [CAS NO. 010022-70-5]
010022-70-5
23,700,086
sodium;hypochlorite;pentahydrate
O.O.O.O.O.[O-]Cl.[Na+]
InChI=1S/ClO.Na.5H2O/c1-2;;;;;;/h;;5*1H2/q-1;+1;;;;;
FHKLOBNGYGFRSF-UHFFFAOYSA-N
ClH10NaO6
164.52
164.00636
null
28.1
4
0
5
6
0
8
null
null
1
0
0
1
0
0
1
1
0
0
0
1
0
0
0
0
1
0
0
0
NITRIC ACID, TERBIUM(3+) SALT
010043-27-3
24,853
terbium(3+) trinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Tb+3]
InChI=1S/3NO3.Tb/c3*2-1(3)4;/q3*-1;+3
YJVUGDIORBKPLC-UHFFFAOYSA-N
N3O9Tb
344.94
344.88881
null
189
18
0
0
9
0
13
null
null
1
0
0
0
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
1
LANTHANUM NITRATE
010099-59-9
25,122
lanthanum(3+) trinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[La+3]
InChI=1S/La.3NO3/c;3*2-1(3)4/q+3;3*-1
FYDKNKUEBJQCCN-UHFFFAOYSA-N
LaN3O9
324.92
324.869817
null
189
18
0
0
9
0
13
null
null
1
0
0
0
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
1
GADOLINIUM NITRATE SOLID
010168-81-7
159,266
gadolinium(3+) trinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Gd+3]
InChI=1S/Gd.3NO3/c;3*2-1(3)4/q+3;3*-1
MWFSXYMZCVAQCC-UHFFFAOYSA-N
GdN3O9
343.26
343.88756
null
189
18
0
0
9
0
13
null
null
1
0
0
0
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
1
NITRIC ACID, HOLMIUM(3+) SALT
010168-82-8
25,024
holmium(3+) trinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ho+3]
InChI=1S/Ho.3NO3/c;3*2-1(3)4/q+3;3*-1
WDVGLADRSBQDDY-UHFFFAOYSA-N
HoN3O9
350.95
350.893783
null
189
18
0
0
9
0
13
null
null
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
1
NITRIC ACID, YTTRIUM(3+) SALT
010361-93-0
159,283
yttrium(3+) trinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Y+3]
InChI=1S/3NO3.Y/c3*2-1(3)4;/q3*-1;+3
BXJPTTGFESFXJU-UHFFFAOYSA-N
N3O9Y
274.92
274.869292
null
189
18
0
0
9
0
13
null
null
1
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
1
NITRIC ACID, CERIUM(4+) SALT
013093-17-9
166,767
cerium(4+) tetranitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ce+4]
InChI=1S/Ce.4NO3/c;4*2-1(3)4/q+4;4*-1
LQCIDLXXSFUYSA-UHFFFAOYSA-N
CeN4O12
388.14
387.85672
null
252
18
0
0
12
0
17
null
null
1
0
0
0
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
0
IODIC ACID (HIO3), RUBIDIUM SALT
013446-76-9
23,673,706
rubidium(1+) iodate
[O-]I(=O)=O.[Rb+]
InChI=1S/HIO3.Rb/c2-1(3)4;/h(H,2,3,4);/q;+1/p-1
CIOUAZZDKTZOPK-UHFFFAOYSA-M
IO3Rb
260.37
259.80101
null
57.2
49
0
0
3
0
5
null
null
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
1
0
0
PERCHLORIC ACID, COBALT(2+) SALT
013455-31-7
26,064
cobalt(2+) diperchlorate
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Co+2]
InChI=1S/2ClHO4.Co/c2*2-1(3,4)5;/h2*(H,2,3,4,5);/q;;+2/p-2
BSUSEPIPTZNHMN-UHFFFAOYSA-L
Cl2CoO8
257.83
256.830216
null
149
95
0
0
8
0
11
null
null
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
PERCHLORIC ACID, CHROMIUM(3+) SALT
013537-21-8
61,644
chromium(3+) triperchlorate
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Cr+3]
InChI=1S/3ClHO4.Cr/c3*2-1(3,4)5;/h3*(H,2,3,4,5);/q;;;+3/p-3
ZKJMJQVGBCLHFL-UHFFFAOYSA-K
Cl3CrO12
350.34
348.786038
null
223
95
0
0
12
0
16
null
null
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
1
1
0
0
PERCHLORIC ACID, IRON(3+) SALT
013537-24-1
159,679
iron(3+) triperchlorate
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Fe+3]
InChI=1S/3ClHO4.Fe/c3*2-1(3,4)5;/h3*(H,2,3,4,5);/q;;;+3/p-3
LHOWRPZTCLUDOI-UHFFFAOYSA-K
Cl3FeO12
354.19
352.780469
null
223
95
0
0
12
0
16
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
PERCHLORIC ACID, ZINC SALT
013637-61-1
10,199,167
zinc diperchlorate
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Zn+2]
InChI=1S/2ClHO4.Zn/c2*2-1(3,4)5;/h2*(H,2,3,4,5);/q;;+2/p-2
RXBXBWBHKPGHIB-UHFFFAOYSA-L
Cl2O8Zn
264.3
261.826164
null
149
95
0
0
8
0
11
null
null
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
Indium-nitrate-
013770-61-1
54,603,292
null
[N+](=O)(O)[O-].[In]
InChI=1S/In.HNO3/c;2-1(3)4/h;(H,2,3,4)
SRNMFPSMASDEKJ-UHFFFAOYSA-N
HInNO3
177.831
177.899522
null
66.1
24
0
1
3
0
5
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
PERCHLORIC ACID, IRON(2+) SALT
013933-23-8
166,947
iron(2+) diperchlorate
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Fe+2]
InChI=1S/2ClHO4.Fe/c2*2-1(3,4)5;/h2*(H,2,3,4,5);/q;;+2/p-2
CKFMJXZQTNRXGX-UHFFFAOYSA-L
Cl2FeO8
254.74
253.831958
null
149
95
0
0
8
0
11
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
1-PROPANAMINIUM, N,N,N-TRIPROPYL-, PERCHLORATE
015780-02-6
85,095
tetrapropylazanium perchlorate
CCC[N+](CCC)(CCC)CCC.[O-]Cl(=O)(=O)=O
InChI=1S/C12H28N.ClHO4/c1-5-9-13(10-6-2,11-7-3)12-8-4;2-1(3,4)5/h5-12H2,1-4H3;(H,2,3,4,5)/q+1;/p-1
LJDKWXHIGFOFDB-UHFFFAOYSA-M
C12H28ClNO4
285.81
285.170686
null
74.3
176
0
0
4
8
18
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
OSMATE (OSO42-), DIPOTASSIUM, (T-4)-
019718-36-6
6,100,394
dipotassium;dioxido(dioxo)osmium
[O-][Os](=O)(=O)[O-].[K+].[K+]
InChI=1S/2K.4O.Os/q2*+1;;;2*-1;
JMVOCSLPMGHXPG-UHFFFAOYSA-N
K2O4Os
332.4
333.86855
null
80.3
62
0
0
4
0
7
null
null
0
1
1
1
0
0
0
1
0
0
0
1
0
0
0
0
1
0
0
0
LITHIUM HYPOBROMITE
013824-95-8
44,147,536
lithium hypobromite
[Li+].[O-]Br
InChI=1S/BrO.Li/c1-2;/q-1;+1
JOUZTPYNXDURHJ-UHFFFAOYSA-N
BrLiO
102.9
101.92926
null
23.1
4
0
0
1
0
3
null
null
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
NITRIC-15N ACID
043625-06-5
10,313,048
null
[15N+](=O)(O)[O-]
InChI=1S/HNO3/c2-1(3)4/h(H,2,3,4)/i1+1
GRYLNZFGIOXLOG-OUBTZVSYSA-N
HNO3
64.006
63.992678
0.2
66.1
24
0
1
3
0
4
null
null
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
CERIUM(IV) AMMONIUM NITRATE
010139-51-2
180,504
diazanium;cerium(4+);hexanitrate
[NH4+].[NH4+].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ce+4]
InChI=1S/Ce.6NO3.2H3N/c;6*2-1(3)4;;/h;;;;;;;2*1H3/q+4;6*-1;;/p+2
XMPZTFVPEKAKFH-UHFFFAOYSA-P
CeH8N8O18
548.22
547.9011
null
379
18
0
2
18
0
27
null
null
1
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
1
0
1
MOLYBDOPHOSPHORIC ACID
012026-57-2
11,251,951
phosphoric acid;dodecakis(trioxomolybdenum)
OP(=O)(O)O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O
InChI=1S/12Mo.H3O4P.36O/c;;;;;;;;;;;;1-5(2,3)4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h;;;;;;;;;;;;(H3,1,2,3,4);;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
DHRLEVQXOMLTIM-UHFFFAOYSA-N
H3Mo12O40P
1,825.4
1,823.66324
null
692
112
0
3
40
0
53
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
0
SCANDIUM(3+) PERCHLORATE
014066-05-8
11,013,318
scandium(3+) triperchlorate
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Sc+3]
InChI=1S/3ClHO4.Sc/c3*2-1(3,4)5;/h3*(H,2,3,4,5);/q;;;+3/p-3
UBVKRMCXDCYZQK-UHFFFAOYSA-K
Cl3O12Sc
343.3
341.801441
null
223
95
0
0
12
0
16
null
null
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
VANADIUM NITRATE
null
10,197,655
vanadium nitrate
[N+](=O)([O-])[O-].[V]
InChI=1S/NO3.V/c2-1(3)4;/q-1;
UNDBACGBNSTMHX-UHFFFAOYSA-N
NO3V-
112.947
112.931776
null
62.9
18
-1
0
3
0
5
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
POTASSIUM NITRATE-15N
057654-83-8
10,909,504
potassium dioxido(oxo)(15N)azanium
[15N+](=O)([O-])[O-].[K+]
InChI=1S/K.NO3/c;2-1(3)4/q+1;-1/i;1+1
FGIUAXJPYTZDNR-IEOVAKBOSA-N
KNO3
102.097
101.948559
null
62.9
18
0
0
3
0
5
null
null
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
PALLADIUM OXIDE (PDO2)
012036-04-3
82,845
dioxopalladium
O=[Pd]=O
InChI=1S/2O.Pd
OHQLYLRYQSZVLV-UHFFFAOYSA-N
O2Pd
138.42
137.89331
null
34.1
18
0
0
2
0
3
null
null
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
CALCIUM HYPOCHLORITE
007778-54-3
24,504
calcium dihypochlorite
[O-]Cl.[O-]Cl.[Ca+2]
InChI=1S/Ca.2ClO/c;2*1-2/q+2;2*-1
ZKQDCIXGCQPQNV-UHFFFAOYSA-N
CaCl2O2
142.98
141.890126
null
46.1
2
0
0
2
0
5
null
Decomposes at 100 °C
1
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
NITRIC ACID (>40-<86%)
007697-37-2
944
nitric acid
[N+](=O)(O)[O-]
InChI=1S/HNO3/c2-1(3)4/h(H,2,3,4)
GRYLNZFGIOXLOG-UHFFFAOYSA-N
HNO3
63.013
62.995643
0.2
66.1
24
0
1
3
0
4
null
181 °F at 760 mmHg (NIOSH, 2024)
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
SILVER NITRATE
007761-88-8
24,470
silver nitrate
[N+](=O)([O-])[O-].[Ag+]
InChI=1S/Ag.NO3/c;2-1(3)4/q+1;-1
SQGYOTSLMSWVJD-UHFFFAOYSA-N
AgNO3
169.873
168.89291
null
62.9
18
0
0
3
0
5
null
824 °F at 760 mmHg (Decomposes) (NTP, 1992)
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
1
0
0
0
POTASSIUM BICHROMATE
007778-50-9
24,502
dipotassium;oxido-(oxido(dioxo)chromio)oxy-dioxochromium
[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[K+].[K+]
InChI=1S/2Cr.2K.7O/q;;2*+1;;;;;;2*-1
KMUONIBRACKNSN-UHFFFAOYSA-N
Cr2K2O7
294.18
293.772825
null
124
194
0
0
7
0
11
null
Decomposes at 932 °F (NTP, 1992)
1
1
1
1
0
1
1
0
0
0
1
0
0
1
1
0
1
1
1
0
AMMONIUM CHROMATE
007788-98-9
24,595
diazanium;dioxido(dioxo)chromium
[NH4+].[NH4+].[O-][Cr](=O)(=O)[O-]
InChI=1S/Cr.2H3N.4O/h;2*1H3;;;;/q;;;;;2*-1/p+2
MFFLHUNPSHBKRG-UHFFFAOYSA-P
CrH8N2O4
152.07
151.988911
null
82.3
62
0
2
4
0
7
null
null
1
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
1
1
0
0
COPPER(II) NITRATE, TRIHYDRATE
010031-43-3
9,837,674
copper;dinitrate;trihydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.[Cu+2]
InChI=1S/Cu.2NO3.3H2O/c;2*2-1(3)4;;;/h;;;3*1H2/q+2;2*-1;;;
SXTLQDJHRPXDSB-UHFFFAOYSA-N
CuH6N2O9
241.6
240.936927
null
129
18
0
3
9
0
12
null
null
1
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
0
LEAD NITRATE
010099-74-8
24,924
lead(2+) dinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Pb+2]
InChI=1S/2NO3.Pb/c2*2-1(3)4;/q2*-1;+2
RLJMLMKIBZAXJO-UHFFFAOYSA-N
N2O6Pb
331
331.95229
null
126
18
0
0
6
0
9
null
null
1
0
1
1
0
1
1
1
0
0
0
0
0
1
0
0
0
1
1
0
IODIC ACID
007782-68-5
24,345
iodic acid
OI(=O)=O
InChI=1S/HIO3/c2-1(3)4/h(H,2,3,4)
ICIWUVCWSCSTAQ-UHFFFAOYSA-N
HIO3
175.911
175.89704
-0.3
54.4
46
0
1
3
0
4
null
null
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
SODIUM IODATE
007681-55-2
23,675,764
sodium iodate
[O-]I(=O)=O.[Na+]
InChI=1S/HIO3.Na/c2-1(3)4;/h(H,2,3,4);/q;+1/p-1
WTCBONOLBHEDIL-UHFFFAOYSA-M
INaO3
197.892
197.87899
null
57.2
49
0
0
3
0
5
null
null
0
0
0
1
0
0
0
0
0
0
0
0
0
0
1
0
0
1
0
0
MANGANESE(II) NITRATE HEXAHYDRATE
017141-63-8
17,814,495
manganese(2+);dinitrate;hexahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Mn+2]
InChI=1S/Mn.2NO3.6H2O/c;2*2-1(3)4;;;;;;/h;;;6*1H2/q+2;2*-1;;;;;;
YMKHJSXMVZVZNU-UHFFFAOYSA-N
H12MnN2O12
287.04
286.977067
null
132
18
0
6
12
0
15
null
null
0
0
0
0
0
1
0
1
0
0
0
0
0
0
0
0
1
0
0
1
LITHIUM HYPOCHLORITE
013840-33-0
23,665,767
lithium hypochlorite
[Li+].[O-]Cl
InChI=1S/ClO.Li/c1-2;/q-1;+1
LWXVCCOAQYNXNX-UHFFFAOYSA-N
ClLiO
58.4
57.979771
null
23.1
4
0
0
1
0
3
null
null
1
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
STRONTIUM PEROXIDE
001314-18-7
14,807
strontium peroxide
[O-][O-].[Sr+2]
InChI=1S/O2.Sr/c1-2;/q-2;+2
UHCGLDSRFKGERO-UHFFFAOYSA-N
O2Sr
119.62
119.895442
null
46.1
2
0
0
2
0
3
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
SODIUM PERCARBONATE
015630-89-4
159,762
tetrasodium;hydrogen peroxide;dicarbonate
C(=O)([O-])[O-].C(=O)([O-])[O-].OO.OO.OO.[Na+].[Na+].[Na+].[Na+]
InChI=1S/2CH2O3.4Na.3H2O2/c2*2-1(3)4;;;;;3*1-2/h2*(H2,2,3,4);;;;;3*1-2H/q;;4*+1;;;/p-4
MSLRPWGRFCKNIZ-UHFFFAOYSA-J
C2H6Na4O12
314.02
313.945003
null
248
18
0
6
12
0
18
null
null
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
MANGANESE (II) NITRATE TETRAHYDRATE
010377-66-9
61,511
manganese(2+) dinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Mn+2]
InChI=1S/Mn.2NO3/c;2*2-1(3)4/q+2;2*-1
MIVBAHRSNUNMPP-UHFFFAOYSA-N
MnN2O6
178.95
178.913679
null
126
18
0
0
6
0
9
null
null
0
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
1
0
CALCIUM IODATE
007789-80-2
24,619
calcium diiodate
[O-]I(=O)=O.[O-]I(=O)=O.[Ca+2]
InChI=1S/Ca.2HIO3/c;2*2-1(3)4/h;2*(H,2,3,4)/q+2;;/p-2
UHWJJLGTKIWIJO-UHFFFAOYSA-L
CaI2O6
389.88
389.74102
null
114
36
0
0
6
0
9
null
null
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
IODIC ACID (HIO3), MAGNESIUM SALT
007790-32-1
165,645
magnesium diiodate
[O-]I(=O)=O.[O-]I(=O)=O.[Mg+2]
InChI=1S/2HIO3.Mg/c2*2-1(3)4;/h2*(H,2,3,4);/q;;+2/p-2
UYNRPXVNKVAGAN-UHFFFAOYSA-L
I2MgO6
374.11
373.76347
null
114
36
0
0
6
0
9
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
PERBORIC ACID, SODIUM SALT
011138-47-9
23,711,812
sodium dihydrogen borate
B(O)(O)[O-].[Na+]
InChI=1S/BH2O3.Na/c2-1(3)4;/h2-3H;/q-1;+1
WBQSJYNAUANADO-UHFFFAOYSA-N
BH2NaO3
83.82
83.999468
null
63.5
14
0
2
3
0
5
null
null
0
0
1
1
0
0
0
1
0
0
0
0
0
1
0
0
0
0
0
1
THORIUM(IV) NITRATE
013823-29-5
26,293
thorium(4+) tetranitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Th+4]
InChI=1S/4NO3.Th/c4*2-1(3)4;/q4*-1;+4
VGBPIHVLVSGJGR-UHFFFAOYSA-N
N4O12Th
480.06
479.98933
null
252
18
0
0
12
0
17
null
null
0
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
1
1
ZINC CHROMITE
050922-29-7
72,720,432
zinc;bis(chromium(3+));tetrakis(oxygen(2-))
[O-2].[O-2].[O-2].[O-2].[Cr+3].[Cr+3].[Zn+2]
InChI=1S/2Cr.4O.Zn/q2*+3;4*-2;+2
JQOAZIZLIIOXEW-UHFFFAOYSA-N
Cr2O4Zn
233.4
231.78981
null
4
0
0
0
4
0
7
null
null
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
BARIUM CHROMATE(VI)
010294-40-3
25,136
barium(2+);dioxido(dioxo)chromium
[O-][Cr](=O)(=O)[O-].[Ba+2]
InChI=1S/Ba.Cr.4O/q+2;;;;2*-1
QFFVPLLCYGOFPU-UHFFFAOYSA-N
BaCrO4
253.32
253.82541
null
80.3
62
0
0
4
0
6
null
null
1
1
1
1
0
1
1
0
0
0
1
0
0
1
1
0
0
1
1
0
AMMONIUM NITRATE
006484-52-2
22,985
azanium nitrate
[NH4+].[N+](=O)([O-])[O-]
InChI=1S/NO3.H3N/c2-1(3)4;/h;1H3/q-1;/p+1
DVARTQFDIMZBAA-UHFFFAOYSA-O
H4N2O3
80.044
80.022192
null
63.9
18
0
1
3
0
5
null
Decomposes at 200-260 °C
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
1
ZINC NITRATE
007779-88-6
24,518
zinc dinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Zn+2]
InChI=1S/2NO3.Zn/c2*2-1(3)4;/q2*-1;+2
ONDPHDOFVYQSGI-UHFFFAOYSA-N
N2O6Zn
189.4
187.904778
null
126
18
0
0
6
0
9
null
null
1
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
1
AMMONIUM PERSULFATE
007727-54-0
62,648
diazanium;sulfonatooxy sulfate
[NH4+].[NH4+].[O-]S(=O)(=O)OOS(=O)(=O)[O-]
InChI=1S/2H3N.H2O8S2/c;;1-9(2,3)7-8-10(4,5)6/h2*1H3;(H,1,2,3)(H,4,5,6)
ROOXNKNUYICQNP-UHFFFAOYSA-N
H8N2O8S2
228.21
227.972208
null
152
206
0
2
8
1
12
null
null
0
0
0
1
0
0
0
1
0
0
0
0
0
0
1
0
1
1
0
1
PHOSPHOMOLYBDIC ACID HYDRATE
051429-74-4
16,211,564
phosphoric acid;dodecakis(trioxomolybdenum);hydrate
O.OP(=O)(O)O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O
InChI=1S/12Mo.H3O4P.H2O.36O/c;;;;;;;;;;;;1-5(2,3)4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h;;;;;;;;;;;;(H3,1,2,3,4);1H2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
PDDXOPNEMCREGN-UHFFFAOYSA-N
H5Mo12O41P
1,843.4
1,841.673805
null
693
112
0
4
41
0
54
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
0
LEAD DIOXIDE
001309-60-0
14,793
dioxolead
O=[Pb]=O
InChI=1S/2O.Pb
YADSGOSSYOOKMP-UHFFFAOYSA-N
O2Pb
239
239.96648
null
34.1
18
0
0
2
0
3
null
null
1
0
1
1
0
0
1
0
0
0
0
0
0
1
0
0
0
0
1
0
URANYL NITRATE HEXAHYDRATE
013520-83-7
61,640
dioxouranium;bis(nitric acid);hexahydrate
[N+](=O)(O)[O-].[N+](=O)(O)[O-].O.O.O.O.O.O.O=[U]=O
InChI=1S/2HNO3.6H2O.2O.U/c2*2-1(3)4;;;;;;;;;/h2*(H,2,3,4);6*1H2;;;
WRIBVRZWDPGVQH-UHFFFAOYSA-N
H14N2O14U
504.15
504.09529
null
172
116
0
8
14
0
17
null
null
0
0
1
1
0
0
1
0
0
0
0
0
0
0
0
0
0
0
1
0
NITROUS ACID, CALCIUM SALT
013780-06-8
159,695
calcium dinitrite
N(=O)[O-].N(=O)[O-].[Ca+2]
InChI=1S/Ca.2HNO2/c;2*2-1-3/h;2*(H,2,3)/q+2;;/p-2
AONJRPXZCVADKF-UHFFFAOYSA-L
CaN2O4
132.09
131.948397
null
105
7
0
0
6
0
7
null
null
1
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
0
0
0
0
CYANOGEN CHLORIDE
000506-77-4
10,477
carbononitridic chloride
C(#N)Cl
InChI=1S/CClN/c2-1-3
QPJDMGCKMHUXFD-UHFFFAOYSA-N
CClN
61.47
60.971927
1
23.8
31
0
0
1
0
3
Not Applicable. Not flammable. (USCG, 1999)
55.6 °F at 760 mmHg (USCG, 1999)
1
1
1
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
0
HEXAFLUOROACETONE
000684-16-2
12,695
1,1,1,3,3,3-hexafluoropropan-2-one
C(=O)(C(F)(F)F)C(F)(F)F
InChI=1S/C3F6O/c4-2(5,6)1(10)3(7,8)9
VBZWSGALLODQNC-UHFFFAOYSA-N
C3F6O
166.02
165.985334
1.5
17.1
124
0
0
7
0
10
null
-18 °F at 760 mmHg (NIOSH, 2024)
0
1
1
1
0
0
0
1
0
0
0
0
0
1
0
0
1
0
1
1
SULFUR TETRAFLUORIDE
007783-60-0
24,555
tetrafluoro-lambda4-sulfane
FS(F)(F)F
InChI=1S/F4S/c1-5(2,3)4
QHMQWEPBXSHHLH-UHFFFAOYSA-N
F4S
108.06
107.965684
3.1
1
19
0
0
5
0
5
null
-40 °F at 760 mmHg (EPA, 1998)
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
1
TUNGSTEN HEXAFLUORIDE
007783-82-6
522,684
hexafluorotungsten
F[W](F)(F)(F)(F)F
InChI=1S/6FH.W/h6*1H;/q;;;;;;+6/p-6
NXHILIPIEUBEPD-UHFFFAOYSA-H
F6W
297.83
297.941352
null
0
62
0
0
6
0
7
null
67 °F
0
1
1
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
0
GERMANIUM TETRAFLUORIDE
007783-58-6
82,215
tetrafluorogermane
F[Ge](F)(F)F
InChI=1S/F4Ge/c1-5(2,3)4
PPMWWXLUCOODDK-UHFFFAOYSA-N
F4Ge
148.62
149.91479
null
0
19
0
0
4
0
5
null
null
0
0
1
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
1
0
SILICON TETRAFLUORIDE
007783-61-1
24,556
tetrafluorosilane
F[Si](F)(F)F
InChI=1S/F4Si/c1-5(2,3)4
ABTOQLMXBSRXSM-UHFFFAOYSA-N
F4Si
104.079
103.970539
null
0
19
0
0
4
0
5
null
-86 °C
0
1
1
1
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
HEXAFLUORO-2-BUTYNE
000692-50-2
69,654
1,1,1,4,4,4-hexafluorobut-2-yne
C(#CC(F)(F)F)C(F)(F)F
InChI=1S/C4F6/c5-3(6,7)1-2-4(8,9)10
WBCLXFIDEDJGCC-UHFFFAOYSA-N
C4F6
162.03
161.990419
2.5
0
151
0
0
6
0
10
null
null
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
ACETYL FLUORIDE, TRIFLUORO-
000354-34-7
67,716
2,2,2-trifluoroacetyl fluoride
C(=O)(C(F)(F)F)F
InChI=1S/C2F4O/c3-1(7)2(4,5)6
DCEPGADSNJKOJK-UHFFFAOYSA-N
C2F4O
116.01
115.988527
1.4
17.1
82
0
0
5
0
7
null
null
0
0
1
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
1
1
1-PROPENE, 3,3,3-TRIFLUORO-2-(TRIFLUOROMETHYL)-
000382-10-5
91,450
3,3,3-trifluoro-2-(trifluoromethyl)prop-1-ene
C=C(C(F)(F)F)C(F)(F)F
InChI=1S/C4H2F6/c1-2(3(5,6)7)4(8,9)10/h1H2
QMIWYOZFFSLIAK-UHFFFAOYSA-N
C4H2F6
164.05
164.006069
3.1
0
121
0
0
6
0
10
null
null
0
0
1
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
1
0
PROPANENITRILE, PENTAFLUORO-
000422-04-8
67,906
2,2,3,3,3-pentafluoropropanenitrile
C(#N)C(C(F)(F)F)(F)F
InChI=1S/C3F5N/c4-2(5,1-9)3(6,7)8
MTLOQUGSPBVZEO-UHFFFAOYSA-N
C3F5N
145.03
144.99509
1.8
23.8
147
0
0
6
0
9
null
null
0
1
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
PROPANOYL FLUORIDE, PENTAFLUORO-
000422-61-7
67,912
2,2,3,3,3-pentafluoropropanoyl fluoride
C(=O)(C(C(F)(F)F)(F)F)F
InChI=1S/C3F6O/c4-1(10)2(5,6)3(7,8)9
YLCLKCNTDGWDMD-UHFFFAOYSA-N
C3F6O
166.02
165.985334
2
17.1
146
0
0
7
1
10
null
null
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
CHLORODIFLUROMETHANE
000075-45-6
6,372
chloro(difluoro)methane
C(F)(F)Cl
InChI=1S/CHClF2/c2-1(3)4/h1H
VOPWNXZWBYDODV-UHFFFAOYSA-N
CHClF2
86.47
85.973484
1.8
0
13
0
0
2
0
4
null
-40.9 °F at 760 mmHg (USCG, 1999)
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
CHLOROPENTAFLUOROETHANE
000076-15-3
6,430
1-chloro-1,1,2,2,2-pentafluoroethane
C(C(F)(F)Cl)(F)(F)F
InChI=1S/C2ClF5/c3-1(4,5)2(6,7)8
RFCAUADVODFSLZ-UHFFFAOYSA-N
C2ClF5
154.46
153.960869
2.6
0
82
0
0
5
0
8
null
-38 °F at 760 mmHg (NIOSH, 2024)
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
FREON 12
000075-71-8
6,391
dichloro(difluoro)methane
C(F)(F)(Cl)Cl
InChI=1S/CCl2F2/c2-1(3,4)5
PXBRQCKWGAHEHS-UHFFFAOYSA-N
CCl2F2
120.91
119.934512
2.3
0
30
0
0
2
0
5
null
-21.6 °F at 760 mmHg (NTP, 1992)
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
DICHLOROFLUOROMETHANE
000075-43-4
6,370
dichloro(fluoro)methane
C(F)(Cl)Cl
InChI=1S/CHCl2F/c2-1(3)4/h1H
UMNKXPULIDJLSU-UHFFFAOYSA-N
CHCl2F
102.92
101.943934
2
0
13
0
0
1
0
4
null
48 °F at 760 mmHg (USCG, 1999)
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
NEON
007440-01-9
23,935
neon
[Ne]
InChI=1S/Ne
GKAOGPIIYCISHV-UHFFFAOYSA-N
Ne
20.18
19.99244
null
0
0
0
0
0
0
1
null
-246.053 °C
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
KRYPTON
007439-90-9
5,416
krypton
[Kr]
InChI=1S/Kr
DNNSSWSSYDEUBZ-UHFFFAOYSA-N
Kr
83.8
83.911498
null
0
0
0
0
0
0
1
null
-153 °C
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
CHLOROTRIFLUOROMETHANE
000075-72-9
6,392
chloro(trifluoro)methane
C(F)(F)(F)Cl
InChI=1S/CClF3/c2-1(3,4)5
AFYPFACVUDMOHA-UHFFFAOYSA-N
CClF3
104.46
103.964062
2
0
28
0
0
3
0
5
null
-114 °F at 760 mmHg (USCG, 1999)
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1,1,1,2-TETRAFLUOROETHANE
000811-97-2
13,129
1,1,1,2-tetrafluoroethane
C(C(F)(F)F)F
InChI=1S/C2H2F4/c3-1-2(4,5)6/h1H2
LVGUZGTVOIAKKC-UHFFFAOYSA-N
C2H2F4
102.03
102.009263
1.7
0
35
0
0
4
0
6
null
-26.5 °C at 1 atmosphere
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
BROMOCHLORODIFLUOROMETHANE
000353-59-3
9,625
bromo-chloro-difluoromethane
C(F)(F)(Cl)Br
InChI=1S/CBrClF2/c2-1(3,4)5
MEXUFEQDCXZEON-UHFFFAOYSA-N
CBrClF2
165.36
163.884
2.4
0
36
0
0
2
0
5
null
-3.7 °C
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
OCTAFLUOROPROPANE
000076-19-7
6,432
1,1,1,2,2,3,3,3-octafluoropropane
C(C(F)(F)F)(C(F)(F)F)(F)F
InChI=1S/C3F8/c4-1(5,2(6,7)8)3(9,10)11
QYSGYZVSCZSLHT-UHFFFAOYSA-N
C3F8
188.02
187.987225
3.1
0
120
0
0
8
0
11
null
-36.7 °C
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
FREON 124
002837-89-0
17,822
2-chloro-1,1,1,2-tetrafluoroethane
C(C(F)(F)F)(F)Cl
InChI=1S/C2HClF4/c3-1(4)2(5,6)7/h1H
BOUGCJDAQLKBQH-UHFFFAOYSA-N
C2HClF4
136.47
135.97029
2.4
0
57
0
0
4
0
7
null
13.6 °F at 760 mmHg (USCG, 1999)
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1,1,1,2,3,3,3-HEPTAFLUOROPROPANE
000431-89-0
67,940
1,1,1,2,3,3,3-heptafluoropropane
C(C(F)(F)F)(C(F)(F)F)F
InChI=1S/C3HF7/c4-1(2(5,6)7)3(8,9)10/h1H
YFMFNYKEUDLDTL-UHFFFAOYSA-N
C3HF7
170.03
169.996647
2.9
0
93
0
0
7
0
10
null
-16.34 °C
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1,1,1,2,3,3-HEXAFLUOROPROPANE
000431-63-0
79,009
1,1,1,2,3,3-hexafluoropropane
C(C(F)F)(C(F)(F)F)F
InChI=1S/C3H2F6/c4-1(2(5)6)3(7,8)9/h1-2H
FYIRUPZTYPILDH-UHFFFAOYSA-N
C3H2F6
152.04
152.006069
2.6
0
82
0
0
6
1
9
null
null
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1,1,1,3,3,3-HEXAFLUOROPROPANE
000690-39-1
12,722
1,1,1,3,3,3-hexafluoropropane
C(C(F)(F)F)C(F)(F)F
InChI=1S/C3H2F6/c4-2(5,6)1-3(7,8)9/h1H2
NSGXIBWMJZWTPY-UHFFFAOYSA-N
C3H2F6
152.04
152.006069
2.8
0
73
0
0
6
0
9
null
-1.1 °C
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
HELIUM, ISOTOPE OF MASS 3
014762-55-1
6,857,639
helium-3
[3He]
InChI=1S/He/i1-1
SWQJXJOGLNCZEY-BJUDXGSMSA-N
He
3.016029
3.016029
null
0
0
0
0
0
0
1
null
null
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
(1E)-1,3,3,3-TETRAFLUOROPROPENE
029118-24-9
5,708,720
(E)-1,3,3,3-tetrafluoroprop-1-ene
C(=C/F)\C(F)(F)F
InChI=1S/C3H2F4/c4-2-1-3(5,6)7/h1-2H/b2-1+
CDOOAUSHHFGWSA-OWOJBTEDSA-N
C3H2F4
114.04
114.009263
1.7
0
69
0
0
4
0
7
null
null
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
2,3,3,3-TETRAFLUORO-2- (TRIFLUOROMETHYL)-PROPANENITRILE
042532-60-5
12,633,773
2,3,3,3-tetrafluoro-2-(trifluoromethyl)propanenitrile
C(#N)C(C(F)(F)F)(C(F)(F)F)F
InChI=1S/C4F7N/c5-2(1-12,3(6,7)8)4(9,10)11
AASDJASZOZGYMM-UHFFFAOYSA-N
C4F7N
195.04
194.991896
2.4
23.8
200
0
0
8
0
12
null
null
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
2-CHLORO-1,1,1-TRIFLUORO-ETHANE (HCFC-133A)
000075-88-7
6,408
2-chloro-1,1,1-trifluoroethane
C(C(F)(F)F)Cl
InChI=1S/C2H2ClF3/c3-1-2(4,5)6/h1H2
CYXIKYKBLDZZNW-UHFFFAOYSA-N
C2H2ClF3
118.48
117.979712
1.9
0
38
0
0
3
0
6
null
6.1 °C
0
0
0
0
0
0
0
0
0
0
0
0
0
0
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