Datasets:
Anonymous-07
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SafeChem

Dataset card Data Studio Files
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1
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
LITHIUM PERCHLORATE
007791-03-9
23,665,649
lithium perchlorate
[Li+].[O-]Cl(=O)(=O)=O
InChI=1S/ClHO4.Li/c2-1(3,4)5;/h(H,2,3,4,5);/q;+1/p-1
MHCFAGZWMAWTNR-UHFFFAOYSA-M
ClLiO4
106.4
105.964515
null
74.3
118
0
0
4
0
6
null
null
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
1
1
PALLADIUM OXIDE
001314-08-5
5,083,724
oxopalladium
O=[Pd]
InChI=1S/O.Pd
HBEQXAKJSGXAIQ-UHFFFAOYSA-N
OPd
122.42
121.89839
null
17.1
2
0
0
1
0
2
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
PLATINUM OXIDE
001314-15-4
345,198
dioxoplatinum
O=[Pt]=O
InChI=1S/2O.Pt
YKIOKAURTKXMSB-UHFFFAOYSA-N
O2Pt
227.08
226.954624
null
34.1
18
0
0
2
0
3
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
RHODIUM(III) OXIDE
012036-35-0
159,409
tris(oxygen(2-));bis(rhodium(3+))
[O-2].[O-2].[O-2].[Rh+3].[Rh+3]
InChI=1S/3O.2Rh/q3*-2;2*+3
XBBXDTCPEWHXKL-UHFFFAOYSA-N
O3Rh2
253.809
253.79573
null
3
0
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
RUTHENIUM TETROXIDE
020427-56-9
119,079
tetraoxoruthenium
O=[Ru](=O)(=O)=O
InChI=1S/4O.Ru
GJFMDWMEOCWXGJ-UHFFFAOYSA-N
O4Ru
165.1
165.883999
null
68.3
138
0
0
4
0
5
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
IODINE PENTAFLUORIDE
007783-66-6
522,683
pentafluoro-lambda5-iodane
FI(F)(F)(F)F
InChI=1S/F5I/c1-6(2,3,4)5
PJIYEPACCBMRLZ-UHFFFAOYSA-N
F5I
221.8965
221.89649
3.6
0
37
0
0
5
0
6
null
null
0
1
1
1
0
0
1
0
0
0
0
0
0
0
0
0
1
0
0
1
POTASSIUM SUPEROXIDE
012030-88-5
61,541
potassium molecular oxygen
O=O.[K+]
InChI=1S/K.O2/c;1-2/q+1;
CLSKHAYBTFRDOV-UHFFFAOYSA-N
KO2+
71.097
70.953536
null
34.1
0
1
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
0
CALCIUM PERCHLORATE
013477-36-6
61,629
calcium diperchlorate
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ca+2]
InChI=1S/Ca.2ClHO4/c;2*2-1(3,4)5/h;2*(H,2,3,4,5)/q+2;;/p-2
ZQAOXERLHGRFIC-UHFFFAOYSA-L
CaCl2O8
238.98
237.859613
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
0
0
0
0
CESIUM PERCHLORATE
013454-84-7
123,309
cesium perchlorate
[O-]Cl(=O)(=O)=O.[Cs+]
InChI=1S/ClHO4.Cs/c2-1(3,4)5;/h(H,2,3,4,5);/q;+1/p-1
WKDKOOITVYKILI-UHFFFAOYSA-M
ClCsO4
232.35
231.853963
null
74.3
118
0
0
4
0
6
null
null
0
0
1
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
RHODIUM (III) NITRATE DIHYDRATE
013465-43-5
23,165,641
rhodium(3+);trinitrate;dihydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.[Rh+3]
InChI=1S/3NO3.2H2O.Rh/c3*2-1(3)4;;;/h;;;2*1H2;/q3*-1;;;+3
SULCFFJNLVZXGH-UHFFFAOYSA-N
H4N3O11Rh
324.95
324.89008
null
191
18
0
2
11
0
15
null
null
1
0
0
1
0
0
1
1
0
0
1
1
0
0
0
0
1
1
0
0
LITHIUM PEROXIDE
012031-80-0
25,489
dilithium;peroxide
[Li+].[Li+].[O-][O-]
InChI=1S/2Li.O2/c;;1-2/q2*+1;-2
HPGPEWYJWRWDTP-UHFFFAOYSA-N
Li2O2
45.9
46.021836
null
46.1
4
0
0
2
0
4
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
0
XENON DIFLUORIDE
013709-36-9
83,674
difluoroxenon
F[Xe]F
InChI=1S/F2Xe/c1-3-2
IGELFKKMDLGCJO-UHFFFAOYSA-N
F2Xe
169.29
169.900961
null
0
2
0
0
2
0
3
null
null
0
0
1
1
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
NITROSYLSULFURIC ACID
007782-78-7
82,157
nitroso hydrogen sulfate
N(=O)OS(=O)(=O)O
InChI=1S/HNO5S/c2-1-6-7(3,4)5/h(H,3,4,5)
VQTGUFBGYOIUFS-UHFFFAOYSA-N
HNO5S
127.08
126.957543
-0.9
101
136
0
1
6
1
7
null
null
0
1
1
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
0
RHODIUM TRINITRATE
010139-58-9
150,190
rhodium(3+) trinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Rh+3]
InChI=1S/3NO3.Rh/c3*2-1(3)4;/q3*-1;+3
VXNYVYJABGOSBX-UHFFFAOYSA-N
N3O9Rh
288.92
288.86895
null
189
18
0
0
9
0
13
null
null
1
0
0
1
0
0
1
1
0
0
1
1
0
0
0
0
1
1
0
0
PALLADIUM(II) NITRATE DIHYDRATE
032916-07-7
44,134,881
palladium(2+);dinitrate;dihydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.[Pd+2]
InChI=1S/2NO3.2H2O.Pd/c2*2-1(3)4;;;/h;;2*1H2;/q2*-1;;;+2
JUBNUQXDQDMSKL-UHFFFAOYSA-N
H4N2O8Pd
266.46
265.90025
null
128
18
0
2
8
0
11
null
null
1
0
0
1
0
0
1
1
0
0
0
1
0
0
0
0
1
0
0
0
BARIUM PERCHLORATE TRIHYDRATE
010294-39-0
53,249,218
barium(2+);diperchlorate;trihydrate
O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ba+2]
InChI=1S/Ba.2ClHO4.3H2O/c;2*2-1(3,4)5;;;/h;2*(H,2,3,4,5);3*1H2/q+2;;;;;/p-2
NBHDMFAHVJWOHD-UHFFFAOYSA-L
BaCl2H6O11
390.27
389.833963
null
152
95
0
3
11
0
14
null
null
0
0
1
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
CHROMIUM COPPER OXIDE
011104-65-7
159,349
chromium;copper;oxygen(2-)
[O-2].[Cr].[Cu]
InChI=1S/Cr.Cu.O/q;;-2
PSJHTNRVTMXYER-UHFFFAOYSA-N
CrCuO-2
131.54
130.865016
null
1
0
-2
0
1
0
3
null
null
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
PERCHLORIC ACID-D
019029-50-6
3,084,301
deuterio perchlorate
[2H]OCl(=O)(=O)=O
InChI=1S/ClHO4/c2-1(3,4)5/h(H,2,3,4,5)/i/hD
VLTRZXGMWDSKGL-DYCDLGHISA-N
ClHO4
101.46
100.962613
2.3
71.4
114
0
1
4
0
5
null
null
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
CHROMIUM(VI) OXIDE
001333-82-0
14,915
trioxochromium
O=[Cr](=O)=O
InChI=1S/Cr.3O
WGLPBDUCMAPZCE-UHFFFAOYSA-N
CrO3
99.994
99.925249
null
51.2
61
0
0
3
0
4
null
482 °F at 760 mmHg (decomposes) (NTP, 1992)
1
1
1
1
0
1
1
1
0
0
1
0
0
1
1
0
1
1
1
0
SODIUM CHLORATE
007775-09-9
516,902
sodium chlorate
[O-]Cl(=O)=O.[Na+]
InChI=1S/ClHO3.Na/c2-1(3)4;/h(H,2,3,4);/q;+1/p-1
YZHUMGUJCQRKBT-UHFFFAOYSA-M
ClNaO3
106.44
105.943366
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
0
0
0
0
0
0
STRONTIUM NITRATE
010042-76-9
24,848
strontium dinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Sr+2]
InChI=1S/2NO3.Sr/c2*2-1(3)4;/q2*-1;+2
DHEQXMRUPNDRPG-UHFFFAOYSA-N
N2O6Sr
211.63
211.881248
null
126
18
0
0
6
0
9
null
1193 °F at 760 mmHg (USCG, 1999)
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
CHLORIC ACID, BARIUM SALT
013477-00-4
26,059
barium(2+) dichlorate
[O-]Cl(=O)=O.[O-]Cl(=O)=O.[Ba+2]
InChI=1S/Ba.2ClHO3/c;2*2-1(3)4/h;2*(H,2,3,4)/q+2;;/p-2
ISFLYIRWQDJPDR-UHFFFAOYSA-L
BaCl2O6
304.23
303.81244
null
114
36
0
0
6
0
9
null
null
0
0
1
1
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
SODIUM BROMATE
007789-38-0
23,668,195
sodium bromate
[O-]Br(=O)=O.[Na+]
InChI=1S/BrHO3.Na/c2-1(3)4;/h(H,2,3,4);/q;+1/p-1
XUXNAKZDHHEHPC-UHFFFAOYSA-M
BrNaO3
150.89
149.89285
null
57.2
49
0
0
3
0
5
null
null
0
0
0
1
0
1
0
1
0
0
1
0
0
0
0
0
1
0
0
1
SODIUM CHLORITE
007758-19-2
23,668,197
sodium chlorite
[O-]Cl=O.[Na+]
InChI=1S/ClHO2.Na/c2-1-3;/h(H,2,3);/q;+1/p-1
UKLNMMHNWFDKNT-UHFFFAOYSA-M
ClNaO2
90.44
89.948451
null
40.1
13
0
0
2
0
4
null
null
1
1
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
1
0
SODIUM PERIODATE
007790-28-5
23,667,635
sodium periodate
[O-]I(=O)(=O)=O.[Na+]
InChI=1S/HIO4.Na/c2-1(3,4)5;/h(H,2,3,4,5);/q;+1/p-1
JQWHASGSAFIOCM-UHFFFAOYSA-M
INaO4
213.892
213.8739
null
74.3
118
0
0
4
0
6
null
Decomposes approx 300 °C
1
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
1
1
ZINC PEROXIDE (ZN(O2))
001314-22-3
14,809
hydrogen peroxide;zinc
OO.[Zn]
InChI=1S/H2O2.Zn/c1-2;/h1-2H;
DLINORNFHVEIFE-UHFFFAOYSA-N
H2O2Zn
99.4
97.934621
null
40.5
2
0
2
2
0
3
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
0
SODIUM ALUMINATE
001302-42-7
14,766
sodium dioxoalumanuide
O=[Al-]=O.[Na+]
InChI=1S/Al.Na.2O/q-1;+1;;
IYJYQHRNMMNLRH-UHFFFAOYSA-N
AlNaO2
81.97
81.961137
null
34.1
18
0
0
3
0
4
null
null
0
0
0
0
0
0
0
1
0
0
0
1
0
0
0
0
1
0
0
0
CHROMIC ACID
007738-94-5
24,425
dihydroxy(dioxo)chromium
O[Cr](=O)(=O)O
InChI=1S/Cr.2H2O.2O/h;2*1H2;;/q+2;;;;/p-2
KRVSOGSZCMJSLX-UHFFFAOYSA-L
CrH2O4
118.01
117.935813
null
74.6
81
0
2
4
0
5
null
Decomposes at about 250 °C /Anhydrous chromic acid, chromic trioxide/
1
1
1
1
0
1
1
1
0
0
1
0
0
1
1
0
1
1
1
0
SODIUM PERCHLORATE MONOHYDRATE
007791-07-3
516,899
sodium;perchlorate;hydrate
O.[O-]Cl(=O)(=O)=O.[Na+]
InChI=1S/ClHO4.Na.H2O/c2-1(3,4)5;;/h(H,2,3,4,5);;1H2/q;+1;/p-1
IXGNPUSUVRTQGW-UHFFFAOYSA-M
ClH2NaO5
140.45
139.948845
null
75.3
118
0
1
5
0
7
null
null
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
POTASSIUM CHLORATE
003811-04-9
6,426,889
potassium chlorate
[O-]Cl(=O)=O.[K+]
InChI=1S/ClHO3.K/c2-1(3)4;/h(H,2,3,4);/q;+1/p-1
VKJKEPKFPUWCAS-UHFFFAOYSA-M
ClKO3
122.55
121.917303
null
57.2
49
0
0
3
0
5
null
400 °C (decomposes)
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
HYDROGEN PEROXIDE SOLUTIONS (27.5-<52%)
007722-84-1
784
hydrogen peroxide
OO
InChI=1S/H2O2/c1-2/h1-2H
MHAJPDPJQMAIIY-UHFFFAOYSA-N
H2O2
34.015
34.005479
-0.9
40.5
0
0
2
2
0
2
null
302.4 °F at 760 mmHg (NTP, 1992)
0
0
1
1
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
CHROMYL CHLORIDE (CRVI)
014977-61-8
22,150,757
chromium(6+);bis(oxygen(2-));dichloride
[O-2].[O-2].[Cl-].[Cl-].[Cr+6]
InChI=1S/2ClH.Cr.2O/h2*1H;;;/q;;+6;2*-2/p-2
AKNPEMSZIKCOGC-UHFFFAOYSA-L
Cl2CrO2
154.9
153.868039
null
2
0
0
0
4
0
5
null
241 °F at 760 mmHg (USCG, 1999)
1
0
0
0
0
1
1
0
0
0
1
0
0
0
0
0
1
1
0
0
TETRANITROMETHANE
000509-14-8
10,509
tetranitromethane
C([N+](=O)[O-])([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]
InChI=1S/CN4O8/c6-2(7)1(3(8)9,4(10)11)5(12)13
NYTOUQBROMCLBJ-UHFFFAOYSA-N
CN4O8
196.03
195.971613
0.1
183
209
0
0
8
0
13
greater than 235 °F (NTP, 1992)
259 °F at 760 mmHg (EPA, 1998)
0
0
1
1
0
1
0
1
0
0
0
0
0
0
0
0
1
0
0
1
CHROMIC NITRATE NONAHYDRATE
007789-02-8
9,887,206
chromium(3+);trinitrate;nonahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.O.O.O.[Cr+3]
InChI=1S/Cr.3NO3.9H2O/c;3*2-1(3)4;;;;;;;;;/h;;;;9*1H2/q+3;3*-1;;;;;;;;;
GVHCUJZTWMCYJM-UHFFFAOYSA-N
CrH18N3O18
400.15
399.99904
null
198
18
0
9
18
0
22
null
No boiling point at normal pressure; decomposes on heating
0
0
1
1
0
0
1
1
0
0
0
0
0
0
0
0
1
1
0
0
CALCIUM NITRATE
010124-37-5
24,963
calcium dinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ca+2]
InChI=1S/Ca.2NO3/c;2*2-1(3)4/q+2;2*-1
ZCCIPPOKBCJFDN-UHFFFAOYSA-N
CaN2O6
164.09
163.938227
null
126
18
0
0
6
0
9
null
null
0
0
1
1
0
0
0
1
0
0
0
1
0
0
0
0
1
0
0
0
FERRIC NITRATE, NONAHYDRATE
007782-61-8
16,211,566
iron(3+);trinitrate;nonahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.O.O.O.[Fe+3]
InChI=1S/Fe.3NO3.9H2O/c;3*2-1(3)4;;;;;;;;;/h;;;;9*1H2/q+3;3*-1;;;;;;;;;
SZQUEWJRBJDHSM-UHFFFAOYSA-N
FeH18N3O18
404
403.993471
null
198
18
0
9
18
0
22
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
LITHIUM NITRATE
007790-69-4
10,129,889
lithium nitrate
[Li+].[N+](=O)([O-])[O-]
InChI=1S/Li.NO3/c;2-1(3)4/q+1;-1
IIPYXGDZVMZOAP-UHFFFAOYSA-N
LiNO3
69
69.003821
null
62.9
18
0
0
3
0
5
null
null
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
POTASSIUM NITRITE
007758-09-0
516,910
potassium nitrite
N(=O)[O-].[K+]
InChI=1S/K.HNO2/c;2-1-3/h;(H,2,3)/q+1;/p-1
BXNHTSHTPBPRFX-UHFFFAOYSA-M
KNO2
85.104
84.95661
null
52.5
13
0
0
3
0
4
null
537 °C (explodes)
1
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
POTASSIUM PERMANGANATE
007722-64-7
516,875
potassium permanganate
[O-][Mn](=O)(=O)=O.[K+]
InChI=1S/K.Mn.4O/q+1;;;;;-1
VZJVWSHVAAUDKD-UHFFFAOYSA-N
KMnO4
158.034
157.881408
null
74.3
118
0
0
4
0
6
null
null
1
0
0
1
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
SODIUM NITRATE
007631-99-4
24,268
sodium nitrate
[N+](=O)([O-])[O-].[Na+]
InChI=1S/NO3.Na/c2-1(3)4;/q-1;+1
VWDWKYIASSYTQR-UHFFFAOYSA-N
NNaO3
84.995
84.977587
null
62.9
18
0
0
3
0
5
null
Decomposes 716 °F (USCG, 1999)
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
SODIUM NITRITE
007632-00-0
23,668,193
sodium nitrite
N(=O)[O-].[Na+]
InChI=1S/HNO2.Na/c2-1-3;/h(H,2,3);/q;+1/p-1
LPXPTNMVRIOKMN-UHFFFAOYSA-M
NNaO2
68.995
68.982673
null
52.5
13
0
0
3
0
4
null
Decomposes at 608 °F (NTP, 1992)
1
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
THORIUM METAL
007440-29-1
23,960
thorium
[Th]
InChI=1S/Th
ZSLUVFAKFWKJRC-UHFFFAOYSA-N
Th
232.038
232.03805
null
0
0
0
0
0
0
1
null
4788 °C
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
1
1
BARIUM PEROXIDE
001304-29-6
14,773
barium(2+) peroxide
[O-][O-].[Ba+2]
InChI=1S/Ba.O2/c;1-2/q+2;-2
ZJRXSAYFZMGQFP-UHFFFAOYSA-N
BaO2
169.33
169.895076
null
46.1
2
0
0
2
0
3
null
800 °C (decomposes)
0
0
1
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
PALLADIUM(II) NITRATE HYDRATE
207596-32-5
16,211,503
palladium(2+);dinitrate;hydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.[Pd+2]
InChI=1S/2NO3.H2O.Pd/c2*2-1(3)4;;/h;;1H2;/q2*-1;;+2
DTZRLFJKQHIVQA-UHFFFAOYSA-N
H2N2O7Pd
248.45
247.88968
null
127
18
0
1
7
0
10
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
SCANDIUM NITRATE
013465-60-6
166,818
scandium(3+) trinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Sc+3]
InChI=1S/3NO3.Sc/c3*2-1(3)4;/q3*-1;+3
DFCYEXJMCFQPPA-UHFFFAOYSA-N
N3O9Sc
230.97
230.919361
null
189
18
0
0
9
0
13
null
null
0
0
0
0
0
1
0
1
0
0
0
0
0
0
0
0
1
0
0
1
SODIUM COBALTINITRITE
013600-98-1
159,748
trisodium;cobalt(3+);hexanitrite
N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].[Na+].[Na+].[Na+].[Co+3]
InChI=1S/Co.6HNO2.3Na/c;6*2-1-3;;;/h;6*(H,2,3);;;/q+3;;;;;;;3*+1/p-6
ZEBNDJQGEZXBCR-UHFFFAOYSA-H
CoN6Na3O12
403.94
403.859921
null
315
7
0
0
18
0
22
null
null
0
0
0
0
0
1
0
1
0
0
0
0
0
0
1
0
1
1
0
1
SODIUM PERRHENATE
013472-33-8
5,107,658
sodium oxido(trioxo)rhenium
[O-][Re](=O)(=O)=O.[Na+]
InChI=1S/Na.4O.Re/q+1;;;;-1;
KMISVFTVBOPTAI-UHFFFAOYSA-N
NaO4Re
273.19
273.92518
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
RUBIDIUM NITRATE
013126-12-0
25,731
rubidium(1+) nitrate
[N+](=O)([O-])[O-].[Rb+]
InChI=1S/NO3.Rb/c2-1(3)4;/q-1;+1
RTHYXYOJKHGZJT-UHFFFAOYSA-N
NO3Rb
147.473
146.899608
null
62.9
18
0
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
ZIRCONYL NITRATE
013826-66-9
83,761
bis(nitric acid);oxozirconium
[N+](=O)(O)[O-].[N+](=O)(O)[O-].O=[Zr]
InChI=1S/2HNO3.O.Zr/c2*2-1(3)4;;/h2*(H,2,3,4);;
UJVRJBAUJYZFIX-UHFFFAOYSA-N
H2N2O7Zr
233.25
231.890899
null
149
76
0
2
7
0
10
null
null
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
0
RUBIDIUM CHROMATE
013446-72-5
61,605
dioxido(dioxo)chromium;bis(rubidium(1+))
[O-][Cr](=O)(=O)[O-].[Rb+].[Rb+]
InChI=1S/Cr.4O.2Rb/q;;;2*-1;2*+1
WXLJFWCCZKCVSQ-UHFFFAOYSA-N
CrO4Rb2
286.929
285.743743
null
80.3
62
0
0
4
0
7
null
null
1
0
0
0
0
1
1
0
0
0
0
0
0
0
0
0
0
1
0
0
CERIUM(III) NITRATE, HEXAHYDRATE
010294-41-4
16,211,466
cerium(3+);trinitrate;hexahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Ce+3]
InChI=1S/Ce.3NO3.6H2O/c;3*2-1(3)4;;;;;;/h;;;;6*1H2/q+3;3*-1;;;;;;
QQZMWMKOWKGPQY-UHFFFAOYSA-N
CeH12N3O15
434.22
433.93229
null
195
18
0
6
15
0
19
null
null
1
0
0
0
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
0
LUTETIUM NITRATE
010099-67-9
24,920
lutetium(3+) trinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Lu+3]
InChI=1S/Lu.3NO3/c;3*2-1(3)4/q+3;3*-1
APRNQTOXCXOSHO-UHFFFAOYSA-N
LuN3O9
360.98
360.90423
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
ERBIUM NITRATE PENTAHYDRATE
010031-51-3
53,249,207
erbium(3+);trinitrate;pentahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Er+3]
InChI=1S/Er.3NO3.5H2O/c;3*2-1(3)4;;;;;/h;;;;5*1H2/q+3;3*-1;;;;;
LWHHUEHWVBVASY-UHFFFAOYSA-N
ErH10N3O14
443.35
441.946578
null
194
18
0
5
14
0
18
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
EUROPIUM NITRATE HEXAHYDRATE
010031-53-5
202,256
europium(3+);trinitrate;hexahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Eu+3]
InChI=1S/Eu.3NO3.6H2O/c;3*2-1(3)4;;;;;;/h;;;;6*1H2/q+3;3*-1;;;;;;
JVYYYCWKSSSCEI-UHFFFAOYSA-N
EuH12N3O15
446.07
446.94808
null
195
18
0
6
15
0
19
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
YTTERBIUM NITRATE
013768-67-7
61,678
ytterbium(3+) trinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Yb+3]
InChI=1S/3NO3.Yb/c3*2-1(3)4;/q3*-1;+3
KUBYTSCYMRPPAG-UHFFFAOYSA-N
N3O9Yb
359.06
359.902321
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
POTASSIUM PERRHENATE
010466-65-6
3,661,560
potassium oxido(trioxo)rhenium
[O-][Re](=O)(=O)=O.[K+]
InChI=1S/K.4O.Re/q+1;;;;-1;
QFKRWIFGDGKWLM-UHFFFAOYSA-N
KO4Re
289.3
289.899117
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
IODINE(V) OXIDE
012029-98-0
159,402
iodyl iodate
O=I(=O)OI(=O)=O
InChI=1S/I2O5/c3-1(4)7-2(5)6
BIZCJSDBWZTASZ-UHFFFAOYSA-N
I2O5
333.81
333.78352
-0.2
77.5
123
0
0
5
0
7
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
0
MAGNESIUM PERCHLORATE HEXAHYDRATE
013446-19-0
16,211,969
magnesium;diperchlorate;hexahydrate
O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Mg+2]
InChI=1S/2ClHO4.Mg.6H2O/c2*2-1(3,4)5;;;;;;;/h2*(H,2,3,4,5);;6*1H2/q;;+2;;;;;;/p-2
MGBDNCBRZIMSDZ-UHFFFAOYSA-L
Cl2H12MgO14
331.3
329.945452
null
155
95
0
6
14
0
17
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
SODIUM PERMANGANATE
010101-50-5
23,673,458
sodium permanganate
[O-][Mn](=O)(=O)=O.[Na+]
InChI=1S/Mn.Na.4O/q;+1;;;;-1
WPWYHBSOACXYBB-UHFFFAOYSA-N
MnNaO4
141.925
141.907471
null
74.3
118
0
0
4
0
6
null
null
1
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
1
0
ZINC NITRATE, HEXAHYDRATE
010196-18-6
15,865,313
zinc;dinitrate;hexahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Zn+2]
InChI=1S/2NO3.6H2O.Zn/c2*2-1(3)4;;;;;;;/h;;6*1H2;/q2*-1;;;;;;;+2
JGPSMWXKRPZZRG-UHFFFAOYSA-N
H12N2O12Zn
297.5
295.968166
null
132
18
0
6
12
0
15
null
null
0
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
1
ZIRCONYL NITRATE HYDRATE
014985-18-3
16,211,674
oxozirconium(2+);dinitrate;hydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O=[Zr+2]
InChI=1S/2NO3.H2O.O.Zr/c2*2-1(3)4;;;/h;;1H2;;/q2*-1;;;+2
BGMQNYCWALSARE-UHFFFAOYSA-N
H2N2O8Zr
249.25
247.885814
null
144
20
0
1
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
TERBIUM(III) NITRATE PENTAHYDRATE
057584-27-7
17,924,347
terbium(3+);trinitrate;pentahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Tb+3]
InChI=1S/3NO3.5H2O.Tb/c3*2-1(3)4;;;;;;/h;;;5*1H2;/q3*-1;;;;;;+3
YWROXJNVUWBEPC-UHFFFAOYSA-N
H10N3O14Tb
435.02
434.94163
null
194
18
0
5
14
0
18
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
SILVER NITRITE
007783-99-5
160,904
silver nitrite
N(=O)[O-].[Ag+]
InChI=1S/Ag.HNO2/c;2-1-3/h;(H,2,3)/q+1;/p-1
KKKDGYXNGYJJRX-UHFFFAOYSA-M
AgNO2
153.874
152.89799
null
52.5
7
0
0
3
0
4
null
null
1
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
0
CUPRIC NITRATE HYDRATE
019004-19-4
167,780
dicopper;tetranitrate;pentahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Cu+2].[Cu+2]
InChI=1S/2Cu.4NO3.5H2O/c;;4*2-1(3)4;;;;;/h;;;;;;5*1H2/q2*+2;4*-1;;;;;
IZDJJEMZQZQQQQ-UHFFFAOYSA-N
Cu2H10N4O17
465.19
463.863289
null
257
18
0
5
17
0
23
null
null
1
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
0
AMMONIUM IODATE
013446-09-8
166,805
azanium iodate
[NH4+].[O-]I(=O)=O
InChI=1S/HIO3.H3N/c2-1(3)4;/h(H,2,3,4);1H3
ZRDJERPXCFOFCP-UHFFFAOYSA-N
H4INO3
192.941
192.92359
null
58.2
36
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
0
BISMUTH NITRATE PENTAHYDRATE
010035-06-0
160,911
bismuth;trinitrate;pentahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Bi+3]
InChI=1S/Bi.3NO3.5H2O/c;3*2-1(3)4;;;;;/h;;;;5*1H2/q+3;3*-1;;;;;
FBXVOTBTGXARNA-UHFFFAOYSA-N
BiH10N3O14
485.07
484.99668
null
194
18
0
5
14
0
18
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
CHROMIC ACID, DICESIUM SALT
013454-78-9
61,613
dicesium;dioxido(dioxo)chromium
[O-][Cr](=O)(=O)[O-].[Cs+].[Cs+]
InChI=1S/Cr.2Cs.4O/q;2*+1;;;2*-1
BROHICCPQMHYFY-UHFFFAOYSA-N
CrCs2O4
381.805
381.731067
null
80.3
62
0
0
4
0
7
null
null
1
0
0
0
0
1
1
1
0
0
1
0
0
0
0
0
1
1
0
1
BROMONITROMETHANE
000563-70-2
68,423
bromo(nitro)methane
C([N+](=O)[O-])Br
InChI=1S/CH2BrNO2/c2-1-3(4)5/h1H2
DNPRVXJGNANVCZ-UHFFFAOYSA-N
CH2BrNO2
139.94
138.92689
0.9
45.8
39
0
0
2
0
5
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
COPPER(II) PERCHLORATE HEXAHYDRATE
010294-46-9
12,846,356
copper;diperchlorate;hexahydrate
O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Cu+2]
InChI=1S/2ClHO4.Cu.6H2O/c2*2-1(3,4)5;;;;;;;/h2*(H,2,3,4,5);;6*1H2/q;;+2;;;;;;/p-2
NHELIHXBJRANPL-UHFFFAOYSA-L
Cl2CuH12O14
370.54
368.890008
null
155
95
0
6
14
0
17
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
TETRAMETHYLAMMONIUM PERCHLORATE
002537-36-2
17,337
tetramethylazanium perchlorate
C[N+](C)(C)C.[O-]Cl(=O)(=O)=O
InChI=1S/C4H12N.ClHO4/c1-5(2,3)4;2-1(3,4)5/h1-4H3;(H,2,3,4,5)/q+1;/p-1
ZCWKIFAQRXNZCH-UHFFFAOYSA-M
C4H12ClNO4
173.59
173.045486
null
74.3
115
0
0
4
0
10
null
null
0
1
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
1
1
PERCHLORIC ACID, ZINC SALT, HEXAHYDRATE
010025-64-6
202,253
zinc;diperchlorate;hexahydrate
O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Zn+2]
InChI=1S/2ClHO4.6H2O.Zn/c2*2-1(3,4)5;;;;;;;/h2*(H,2,3,4,5);6*1H2;/q;;;;;;;;+2/p-2
PADPILQDYPIHQQ-UHFFFAOYSA-L
Cl2H12O14Zn
372.4
369.889552
null
155
95
0
6
14
0
17
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
0
RUTHENIUM(IV) OXIDE
012036-10-1
82,848
dioxoruthenium
O=[Ru]=O
InChI=1S/2O.Ru
WOCIAKWEIIZHES-UHFFFAOYSA-N
O2Ru
133.1
133.89417
null
34.1
18
0
0
2
0
3
null
null
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
0
0
0
0
0
PRASEODYMIUM PERCHLORATE
013498-07-2
13,783,608
praseodymium(3+) triperchlorate
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Pr+3]
InChI=1S/3ClHO4.Pr/c3*2-1(3,4)5;/h3*(H,2,3,4,5);/q;;;+3/p-3
OPAITELCMCAYEB-UHFFFAOYSA-K
Cl3O12Pr
439.25
437.75319
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
AMMONIUM NITRATE-15N
031432-46-9
53,393,587
null
N.[15N+](=O)(O)[O-]
InChI=1S/HNO3.H3N/c2-1(3)4;/h(H,2,3,4);1H3/i1+1;
PRORZGWHZXZQMV-YTBWXGASSA-N
H4N2O3
81.037
81.019227
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
AMMONIUM-15N NITRATE
031432-48-1
71,309,194
azane;nitric acid
[15NH3].[N+](=O)(O)[O-]
InChI=1S/HNO3.H3N/c2-1(3)4;/h(H,2,3,4);1H3/i;1+1
PRORZGWHZXZQMV-IEOVAKBOSA-N
H4N2O3
81.037
81.019227
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
BARIUM IODATE
010567-69-8
165,892
barium(2+) diiodate
[O-]I(=O)=O.[O-]I(=O)=O.[Ba+2]
InChI=1S/Ba.2HIO3/c;2*2-1(3)4/h;2*(H,2,3,4)/q+2;;/p-2
GASILTKHXWGKMG-UHFFFAOYSA-L
BaI2O6
487.13
487.68368
null
114
36
0
0
6
0
9
null
null
0
0
1
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
PLATINUM(IV) OXIDE, HYDRATE
052785-06-5
11,139,377
dioxoplatinum;hydrate
O.O=[Pt]=O
InChI=1S/H2O.2O.Pt/h1H2;;;
SPGAMGILENUIOF-UHFFFAOYSA-N
H2O3Pt
245.1
244.965188
null
35.1
18
0
1
3
0
4
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
THULIUM(III) NITRATE PENTAHYDRATE
036548-87-5
71,311,313
thulium(3+);trinitrate;pentahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Tm+3]
InChI=1S/3NO3.5H2O.Tm/c3*2-1(3)4;;;;;;/h;;;5*1H2;/q3*-1;;;;;;+3
PEYIBPJKEYRLDB-UHFFFAOYSA-N
H10N3O14Tm
445.03
444.950496
null
194
18
0
5
14
0
18
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
YTTERBIUM(III) NITRATE PENTAHYDRATE
035725-34-9
16,211,525
ytterbium(3+);trinitrate;pentahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Yb+3]
InChI=1S/3NO3.5H2O.Yb/c3*2-1(3)4;;;;;;/h;;;5*1H2;/q3*-1;;;;;;+3
XIOPWXFTXDPBEY-UHFFFAOYSA-N
H10N3O14Yb
449.14
449.955145
null
194
18
0
5
14
0
18
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
TETRABUTYLAMMONIUM PERCHLORATE
001923-70-2
74,723
tetrabutylazanium perchlorate
CCCC[N+](CCCC)(CCCC)CCCC.[O-]Cl(=O)(=O)=O
InChI=1S/C16H36N.ClHO4/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2-1(3,4)5/h5-16H2,1-4H3;(H,2,3,4,5)/q+1;/p-1
KBLZDCFTQSIIOH-UHFFFAOYSA-M
C16H36ClNO4
341.9
341.233286
null
74.3
212
0
0
4
12
22
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
RUBIDIUM PERCHLORATE
013510-42-4
23,673,707
rubidium(1+) perchlorate
[O-]Cl(=O)(=O)=O.[Rb+]
InChI=1S/ClHO4.Rb/c2-1(3,4)5;/h(H,2,3,4,5);/q;+1/p-1
NQYGGOOZLKJKPS-UHFFFAOYSA-M
ClO4Rb
184.92
183.860301
null
74.3
118
0
0
4
0
6
null
null
0
0
1
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
GUANIDINE NITRATE
000506-93-4
10,481
guanidine;nitric acid
C(=N)(N)N.[N+](=O)(O)[O-]
InChI=1S/CH5N3.HNO3/c2*2-1(3)4/h(H5,2,3,4);(H,2,3,4)
CNUNWZZSUJPAHX-UHFFFAOYSA-N
CH6N4O3
122.08
122.04399
null
142
51
0
4
4
0
8
null
Decomposes at boiling point
0
0
1
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
CESIUM DICHROMATE
013530-67-1
3,084,158
dicesium;oxido-(oxido(dioxo)chromio)oxy-dioxochromium
[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Cs+].[Cs+]
InChI=1S/2Cr.2Cs.7O/q;;2*+1;;;;;;2*-1
AQWIYQPYXQGBQU-UHFFFAOYSA-N
Cr2Cs2O7
481.8
481.656316
null
124
194
0
0
7
0
11
null
null
1
0
0
0
0
1
1
0
0
0
0
0
0
0
0
0
1
1
0
0
TERBIUM NITRATE HEXAHYDRATE
013451-19-9
202,879
terbium(3+);trinitrate;hexahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Tb+3]
InChI=1S/3NO3.6H2O.Tb/c3*2-1(3)4;;;;;;;/h;;;6*1H2;/q3*-1;;;;;;;+3
UTCARTSNNKGRTD-UHFFFAOYSA-N
H12N3O15Tb
453.03
452.9522
null
195
18
0
6
15
0
19
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
THALLIUM(III) NITRATE TRIHYDRATE
013453-38-8
3,084,145
thallium(3+);trinitrate;hexahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Tl+3]
InChI=1S/3NO3.6H2O.Tl/c3*2-1(3)4;;;;;;;/h;;;6*1H2;/q3*-1;;;;;;;+3
TWTZVACKNJEUQF-UHFFFAOYSA-N
H12N3O15Tl
498.49
499.00127
null
195
18
0
6
15
0
19
null
null
0
0
1
1
0
0
1
0
0
0
0
0
0
0
0
0
0
0
1
0
NICKEL (II) PERCHLORATE HEXAHYDRATE
013520-61-1
15,769,463
nickel(2+);diperchlorate;hexahydrate
O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ni+2]
InChI=1S/2ClHO4.Ni.6H2O/c2*2-1(3,4)5;;;;;;;/h2*(H,2,3,4,5);;6*1H2/q;;+2;;;;;;/p-2
WHGYCGOFTBFDLW-UHFFFAOYSA-L
Cl2H12NiO14
365.68
363.895752
null
155
95
0
6
14
0
17
null
null
1
0
0
0
0
1
1
0
0
0
1
0
0
1
1
0
1
1
1
0
MERCURY (II) PERCHLORATE TRIHYDRATE
073491-34-6
53,471,339
mercury(2+);diperchlorate;trihydrate
O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Hg+2]
InChI=1S/2ClHO4.Hg.3H2O/c2*2-1(3,4)5;;;;/h2*(H,2,3,4,5);;3*1H2/q;;+2;;;/p-2
DFJWPGPUWHLJIJ-UHFFFAOYSA-L
Cl2H6HgO11
453.54
453.89936
null
152
95
0
3
11
0
14
null
null
1
1
1
1
0
0
1
0
0
0
0
0
0
0
0
0
0
0
1
0
COBALT (II) PERCHLORATE HEXAHYDRATE
013478-33-6
156,614,046
null
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Co]
InChI=1S/2ClHO4.Co/c2*2-1(3,4)5;/h2*(H,2,3,4,5);/p-2
ODWQRYQLVGSPGU-UHFFFAOYSA-L
Cl2CoO8-2
257.83
256.830216
null
149
95
-2
0
8
0
11
null
null
0
0
0
0
0
1
0
1
0
0
0
0
0
0
0
0
1
1
0
0
ALUMINUM NITRATE
025838-59-9
22,078,336
aluminum;trinitrate;hydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.[Al+3]
InChI=1S/Al.3NO3.H2O/c;3*2-1(3)4;/h;;;;1H2/q+3;3*-1;
ZZCONUBOESKGOK-UHFFFAOYSA-N
AlH2N3O10
231.01
230.955557
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
0
GALLIUM PERCHLORATE
017835-81-3
25,021,700
gallium triperchlorate
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ga+3]
InChI=1S/3ClHO4.Ga/c3*2-1(3,4)5;/h3*(H,2,3,4,5);/q;;;+3/p-3
DKRHELWBVMBPOQ-UHFFFAOYSA-K
Cl3GaO12
368.07
365.77111
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
SODIUM NITRATE-15N
031432-45-8
11,446,290
sodium dioxido(oxo)(15N)azanium
[15N+](=O)([O-])[O-].[Na+]
InChI=1S/NO3.Na/c2-1(3)4;/q-1;+1/i1+1;
VWDWKYIASSYTQR-YTBWXGASSA-N
NNaO3
85.988
85.974622
null
62.9
18
0
0
3
0
5
null
null
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
LITHIUM IODATE
013765-03-2
23,687,747
lithium iodate
[Li+].[O-]I(=O)=O
InChI=1S/HIO3.Li/c2-1(3)4;/h(H,2,3,4);/q;+1/p-1
FZAXZVHFYFGNBX-UHFFFAOYSA-M
ILiO3
181.9
181.90522
null
57.2
49
0
0
3
0
5
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
1
0
0
1
0
0
1
TETRAHEXYLAMMONIUM PERCHLORATE
004656-81-9
78,388
tetrahexylazanium perchlorate
CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[O-]Cl(=O)(=O)=O
InChI=1S/C24H52N.ClHO4/c1-5-9-13-17-21-25(22-18-14-10-6-2,23-19-15-11-7-3)24-20-16-12-8-4;2-1(3,4)5/h5-24H2,1-4H3;(H,2,3,4,5)/q+1;/p-1
RLCKPGXHGKSGOS-UHFFFAOYSA-M
C24H52ClNO4
454.1
453.358487
null
74.3
291
0
0
4
20
30
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
SODIUM NITRITE-15N
068378-96-1
23,662,135
null
[15N](=O)[O-].[Na+]
InChI=1S/HNO2.Na/c2-1-3;/h(H,2,3);/q;+1/p-1/i1+1;
LPXPTNMVRIOKMN-YTBWXGASSA-M
NNaO2
69.989
69.979707
null
52.5
13
0
0
3
0
4
null
null
1
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
CALCIUM PERCHLORATE TETRAHYDRATE
015627-86-8
16,212,580
null
O.OCl(=O)(=O)=O.[Ca]
InChI=1S/Ca.ClHO4.H2O/c;2-1(3,4)5;/h;(H,2,3,4,5);1H2
OOAKCMYXKUVCJJ-UHFFFAOYSA-N
CaClH3O5
158.55
157.929492
null
72.4
114
0
2
5
0
7
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
COPPER(II) NITRATE, HYDRATE
013778-31-9
15,303,652
copper;dinitrate;hydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.[Cu+2]
InChI=1S/Cu.2NO3.H2O/c;2*2-1(3)4;/h;;;1H2/q+2;2*-1;
VMKYLARTXWTBPI-UHFFFAOYSA-N
CuH2N2O7
205.57
204.915798
null
127
18
0
1
7
0
10
null
null
1
0
0
1
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
0
POTASSIUM MANGANATE(VI)
010294-64-1
160,931
dipotassium;dioxido(dioxo)manganese
[O-][Mn](=O)(=O)[O-].[K+].[K+]
InChI=1S/2K.Mn.4O/q2*+1;;;;2*-1
XKYFHUXZPRFUTH-UHFFFAOYSA-N
K2MnO4
197.132
196.845114
null
80.3
62
0
0
4
0
7
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1
CAMBRIDGE ISOTOPE LABORATORIES NITRIC ACID (D, 99%)
013587-52-5
12,025,424
deuterio nitrate
[2H]O[N+](=O)[O-]
InChI=1S/HNO3/c2-1(3)4/h(H,2,3,4)/i/hD
GRYLNZFGIOXLOG-DYCDLGHISA-N
HNO3
64.019
64.00192
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
SILVER (II) FLUORIDE
007783-95-1
82,221
difluorosilver
F[Ag]F
InChI=1S/Ag.2FH/h;2*1H/q+2;;/p-2
KWVVTSALYXIJSS-UHFFFAOYSA-L
AgF2
145.865
144.9019
null
0
2
0
0
2
0
3
null
null
0
1
1
1
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
YTTRIUM(III) NITRATE TETRAHYDRATE
013773-69-8
16,211,569
yttrium(3+);trinitrate;tetrahydrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.[Y+3]
InChI=1S/3NO3.4H2O.Y/c3*2-1(3)4;;;;;/h;;;4*1H2;/q3*-1;;;;;+3
XRKAJAPEZSHSLG-UHFFFAOYSA-N
H8N3O13Y
346.98
346.91155
null
193
18
0
4
13
0
17
null
null
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
1
0
0
1