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
PROPANOIC ACID, 2-CHLORO-, METHYL ESTER, (S)-
073246-45-4
135,535
methyl (2S)-2-chloropropanoate
C[C@@H](C(=O)OC)Cl
InChI=1S/C4H7ClO2/c1-3(5)4(6)7-2/h3H,1-2H3/t3-/m0/s1
JLEJCNOTNLZCHQ-VKHMYHEASA-N
C4H7ClO2
122.55
122.013457
1.1
26.3
72
0
0
2
2
7
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
0
0
1
0
2-BUTANETHIOL, 4-METHOXY-2-METHYL-
094087-83-9
526,195
4-methoxy-2-methylbutane-2-thiol
CC(C)(CCOC)S
InChI=1S/C6H14OS/c1-6(2,8)4-5-7-3/h8H,4-5H2,1-3H3
XVHGKKGBUDMTIQ-UHFFFAOYSA-N
C6H14OS
134.24
134.076536
1.3
10.2
61
0
1
2
3
8
null
159.00 to 160.00 °C. @ 760.00 mm Hg
0
0
0
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
4-ETHOXYBUTANOL
000111-73-9
8,131
4-ethoxybutan-1-ol
CCOCCCCO
InChI=1S/C6H14O2/c1-2-8-6-4-3-5-7/h7H,2-6H2,1H3
QRUOTIJTSNETKW-UHFFFAOYSA-N
C6H14O2
118.17
118.09938
0.8
29.5
37
0
1
2
5
8
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
ETHOXY PROPANOL
001569-02-4
15,287
1-ethoxypropan-2-ol
CCOCC(C)O
InChI=1S/C5H12O2/c1-3-7-4-5(2)6/h5-6H,3-4H2,1-2H3
JOLQKTGDSGKSKJ-UHFFFAOYSA-N
C5H12O2
104.15
104.08373
0.2
29.5
37
0
1
2
3
7
35 °C
133 °C
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
1
1-BUTANOL, ZIRCONIUM(4+) SALT
001071-76-7
160,560
tetrakis(butan-1-olate);zirconium(4+)
CCCC[O-].CCCC[O-].CCCC[O-].CCCC[O-].[Zr+4]
InChI=1S/4C4H9O.Zr/c4*1-2-3-4-5;/h4*2-4H2,1H3;/q4*-1;+4
BSDOQSMQCZQLDV-UHFFFAOYSA-N
C16H36O4Zr
383.68
382.166058
null
92.2
13
0
0
4
8
21
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
0
1
0
0
ALUMINUM DI-S-BUTOXIDE ETHYLACETOACETATE
024772-51-8
54,692,981
aluminum;bis(butan-2-olate);(Z)-4-ethoxy-4-oxobut-2-en-2-olate
CCC(C)[O-].CCC(C)[O-].CCOC(=O)/C=C(/C)\[O-].[Al+3]
InChI=1S/C6H10O3.2C4H9O.Al/c1-3-9-6(8)4-5(2)7;2*1-3-4(2)5;/h4,7H,3H2,1-2H3;2*4H,3H2,1-2H3;/q;2*-1;+3/p-1/b5-4-;;;
FNZMQCYGPHUYMI-OAWHIZORSA-M
C14H27AlO5
302.34
302.167387
null
95.5
146
0
0
5
5
20
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
2,4,6,8-TETRAOXANONANE
013353-03-2
54,136,657
methoxy(methoxymethoxymethoxy)methane
COCOCOCOC
InChI=1S/C5H12O4/c1-6-3-8-5-9-4-7-2/h3-5H2,1-2H3
NYENPQBYHWPGNG-UHFFFAOYSA-N
C5H12O4
136.15
136.073559
-0.1
36.9
42
0
0
4
6
9
null
null
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
TRIETHOXY(2,4,4-TRIMETHYLPENTYL)SILANE
035435-21-3
169,694
triethoxy(2,4,4-trimethylpentyl)silane
CCO[Si](CC(C)CC(C)(C)C)(OCC)OCC
InChI=1S/C14H32O3Si/c1-8-15-18(16-9-2,17-10-3)12-13(4)11-14(5,6)7/h13H,8-12H2,1-7H3
UWZSHGZRSZICIW-UHFFFAOYSA-N
C14H32O3Si
276.49
276.212071
null
27.7
197
0
0
3
10
18
null
null
0
0
0
0
0
0
1
0
1
0
0
0
0
0
0
0
0
0
0
0
3,5-DIMETHYLOCTANE
015869-93-9
139,989
3,5-dimethyloctane
CCCC(C)CC(C)CC
InChI=1S/C10H22/c1-5-7-10(4)8-9(3)6-2/h9-10H,5-8H2,1-4H3
VRHRGVJOUHJULC-UHFFFAOYSA-N
C10H22
142.28
142.172151
5.1
0
66
0
0
0
5
10
null
null
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
4-METHYLNONANE
017301-94-9
28,455
4-methylnonane
CCCCCC(C)CCC
InChI=1S/C10H22/c1-4-6-7-9-10(3)8-5-2/h10H,4-9H2,1-3H3
IALRSQMWHFKJJA-UHFFFAOYSA-N
C10H22
142.28
142.172151
5.3
0
57
0
0
0
6
10
null
null
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
1,1,3,3-TETRAMETHOXY-1,3-DIMETHYLDISILOXANE
018186-97-5
87,496
[dimethoxy(methyl)silyl]oxy-dimethoxy-methylsilane
CO[Si](C)(OC)O[Si](C)(OC)OC
InChI=1S/C6H18O5Si2/c1-7-12(5,8-2)11-13(6,9-3)10-4/h1-6H3
JWVHPGDCFVOYMQ-UHFFFAOYSA-N
C6H18O5Si2
226.37
226.069277
null
46.2
130
0
0
5
6
13
null
null
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
1-CHLORO-2,2-FLUOROETHANE (HCFC-142)
000338-65-8
2,736,499
2-chloro-1,1-difluoroethane
C(C(F)F)Cl
InChI=1S/C2H3ClF2/c3-1-2(4)5/h2H,1H2
ATEBGNALLCMSGS-UHFFFAOYSA-N
C2H3ClF2
100.49
99.989134
1.7
0
21
0
0
2
1
5
null
null
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
GALLIUM (III) ISOPROPOXIDE
null
22,253,272
gallium tris(propan-2-olate)
CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ga+3]
InChI=1S/3C3H7O.Ga/c3*1-3(2)4;/h3*3H,1-2H3;/q3*-1;+3
RLVZHWWAGSWRBR-UHFFFAOYSA-N
C9H21GaO3
246.98
246.07464
null
69.2
10
0
0
3
0
13
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
0
PROPYL VALERATE
null
67,328
propyl pentanoate
CCCCC(=O)OCCC
InChI=1S/C8H16O2/c1-3-5-6-8(9)10-7-4-2/h3-7H2,1-2H3
ROJKPKOYARNFNB-UHFFFAOYSA-N
C8H16O2
144.21
144.11503
2.4
26.3
89
0
0
2
6
10
null
null
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
ETHANEPEROXOIC ACID, 1,1-DIMETHYLETHYL ESTER
000107-71-1
61,019
tert-butyl ethaneperoxoate
CC(=O)OOC(C)(C)C
InChI=1S/C6H12O3/c1-5(7)8-9-6(2,3)4/h1-4H3
SWAXTRYEYUTSAP-UHFFFAOYSA-N
C6H12O3
132.16
132.078644
1.1
35.5
101
0
0
3
3
9
null
null
0
0
1
1
0
0
1
1
1
0
0
0
1
0
0
1
0
1
0
0
METHYL SILICATE
000681-84-5
12,682
tetramethyl silicate
CO[Si](OC)(OC)OC
InChI=1S/C4H12O4Si/c1-5-9(6-2,7-3)8-4/h1-4H3
LFQCEHFDDXELDD-UHFFFAOYSA-N
C4H12O4Si
152.22
152.050485
null
36.9
55
0
0
4
4
9
205 °F (NIOSH, 2024)
250 °F at 760 mmHg (NIOSH, 2024)
0
0
1
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
1
1
ALUMINUM TRI-SEC-BUTOXIDE
002269-22-9
6,451,513
aluminum tris(butan-1-olate)
CCCC[O-].CCCC[O-].CCCC[O-].[Al+3]
InChI=1S/3C4H9O.Al/c3*1-2-3-4-5;/h3*2-4H2,1H3;/q3*-1;+3
MYWQGROTKMBNKN-UHFFFAOYSA-N
C12H27AlO3
246.32
246.177558
null
69.2
13
0
0
3
6
16
null
null
0
1
0
1
0
0
0
1
1
0
0
0
0
0
0
0
0
0
0
1
BROMOACETONE
000598-31-2
11,715
1-bromopropan-2-one
CC(=O)CBr
InChI=1S/C3H5BrO/c1-3(5)2-4/h2H2,1H3
VQFAIAKCILWQPZ-UHFFFAOYSA-N
C3H5BrO
136.98
135.95238
0.7
17.1
42
0
0
1
1
5
124 °F (USCG, 1999)
277 °F at 760 mmHg (USCG, 1999)
0
0
1
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
FORMIC ACID, PENTYL ESTER
000638-49-3
12,529
pentyl formate
CCCCCOC=O
InChI=1S/C6H12O2/c1-2-3-4-5-8-6-7/h6H,2-5H2,1H3
DIQMPQMYFZXDAX-UHFFFAOYSA-N
C6H12O2
116.16
116.08373
1.9
26.3
52
0
0
2
5
8
79 °F (NFPA, 2010)
130.00 to 131.00 °C. @ 760.00 mm Hg
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
0
0
0
1
2-METHYLNONANE
000871-83-0
13,379
2-methylnonane
CCCCCCCC(C)C
InChI=1S/C10H22/c1-4-5-6-7-8-9-10(2)3/h10H,4-9H2,1-3H3
SGVYKUFIHHTIFL-UHFFFAOYSA-N
C10H22
142.28
142.172151
5.3
0
55
0
0
0
6
10
null
null
0
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
(E)-2-BUTENOIC ACID, ETHYL ESTER
000623-70-1
429,065
ethyl (E)-but-2-enoate
CCOC(=O)/C=C/C
InChI=1S/C6H10O2/c1-3-5-6(7)8-4-2/h3,5H,4H2,1-2H3/b5-3+
ZFDIRQKJPRINOQ-HWKANZROSA-N
C6H10O2
114.14
114.06808
1.3
26.3
94
0
0
2
3
8
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
0
0
0
0
2-PENTANOL, 2-ACETATE
000626-38-0
12,278
pentan-2-yl acetate
CCCC(C)OC(=O)C
InChI=1S/C7H14O2/c1-4-5-6(2)9-7(3)8/h6H,4-5H2,1-3H3
GQKZRWSUJHVIPE-UHFFFAOYSA-N
C7H14O2
130.18
130.09938
1.8
26.3
88
0
0
2
4
9
89 °F (USCG, 1999)
271.4 °F at 760 mmHg (USCG, 1999)
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
TRIMETHYL BORATE
000121-43-7
8,470
trimethyl borate
B(OC)(OC)OC
InChI=1S/C3H9BO3/c1-5-4(6-2)7-3/h1-3H3
WRECIMRULFAWHA-UHFFFAOYSA-N
C3H9BO3
103.92
104.064474
null
27.7
31
0
0
3
3
7
less than 80 °F (NFPA, 2010)
67.5 °C
0
1
0
0
0
0
0
0
1
0
0
0
0
1
0
0
0
0
0
0
TITANIUM(IV) N-BUTOXIDE
005593-70-4
21,801
tetrakis(butan-1-olate);titanium(4+)
CCCC[O-].CCCC[O-].CCCC[O-].CCCC[O-].[Ti+4]
InChI=1S/4C4H9O.Ti/c4*1-2-3-4-5;/h4*2-4H2,1H3;/q4*-1;+4
YHWCPXVTRSHPNY-UHFFFAOYSA-N
C16H36O4Ti
340.32
340.2093
null
92.2
13
0
0
4
8
21
170 °F (USCG, 1999)
593 °F at 760 mmHg (USCG, 1999)
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
Phosphorodithioic acid, O,O-dimethyl ester
000756-80-9
12,959
dimethoxy-sulfanyl-sulfanylidene-lambda5-phosphane
COP(=S)(OC)S
InChI=1S/C2H7O2PS2/c1-3-5(6,7)4-2/h1-2H3,(H,6,7)
CZGGKXNYNPJFAX-UHFFFAOYSA-N
C2H7O2PS2
158.18
157.962509
1.7
51.6
85
0
1
4
2
7
null
null
0
0
1
1
0
0
1
1
1
0
0
1
0
1
0
0
1
0
0
0
PROPANAL, 3-(METHYLTHIO)-
003268-49-3
18,635
3-methylsulfanylpropanal
CSCCC=O
InChI=1S/C4H8OS/c1-6-4-2-3-5/h3H,2,4H2,1H3
CLUWOWRTHNNBBU-UHFFFAOYSA-N
C4H8OS
104.17
104.029586
0.3
42.4
36
0
0
2
3
6
142 °F (NFPA, 2010)
BP: 62 °C at 11 mm Hg
0
1
1
1
0
0
1
1
1
0
0
0
0
0
0
0
1
1
0
0
(E,E)-2,4-HEXADIENAL
000142-83-6
637,564
(2E,4E)-hexa-2,4-dienal
C/C=C/C=C/C=O
InChI=1S/C6H8O/c1-2-3-4-5-6-7/h2-6H,1H3/b3-2+,5-4+
BATOPAZDIZEVQF-MQQKCMAXSA-N
C6H8O
96.13
96.057515
1.2
17.1
90
0
0
1
2
7
null
174 °C; 76 °C @ 30 mm Hg
0
1
0
1
0
0
0
1
1
0
0
0
0
0
0
0
1
1
0
0
2,5-DIMETHYL-2,5-DI(TERT-BUTYLPEROXY)HEXANE
000078-63-7
6,545
2,5-bis(tert-butylperoxy)-2,5-dimethylhexane
CC(C)(C)OOC(C)(C)CCC(C)(C)OOC(C)(C)C
InChI=1S/C16H34O4/c1-13(2,3)17-19-15(7,8)11-12-16(9,10)20-18-14(4,5)6/h11-12H2,1-10H3
DMWVYCCGCQPJEA-UHFFFAOYSA-N
C16H34O4
290.44
290.24571
3.9
36.9
252
0
0
4
9
20
185 °F (NTP, 1992)
122 to 126 °F at 0.1 mmHg (NTP, 1992)
0
0
0
0
0
0
1
1
1
0
0
0
1
0
0
1
1
0
0
0
TRIBUTYLPHOSPHINE
000998-40-3
13,831
tributylphosphane
CCCCP(CCCC)CCCC
InChI=1S/C12H27P/c1-4-7-10-13(11-8-5-2)12-9-6-3/h4-12H2,1-3H3
TUQOTMZNTHZOKS-UHFFFAOYSA-N
C12H27P
202.32
202.185038
3.7
0
72
0
0
0
9
13
null
null
0
1
0
1
0
0
1
1
1
0
0
0
0
0
0
0
1
0
0
0
SODIUM HYDROSULFIDE
016721-80-5
28,015
sodium sulfanide
[Na+].[SH-]
InChI=1S/Na.H2S/h;1H2/q+1;/p-1
HYHCSLBZRBJJCH-UHFFFAOYSA-M
HNaS
56.07
55.969665
null
1
2
0
1
1
0
2
null
212 °F at 760 mmHg (approx.) (USCG, 1999)
1
0
0
1
0
0
0
1
1
0
0
1
0
0
0
0
1
0
0
0
ACETIC ACID, MERCAPTO-, METHYL ESTER
002365-48-2
16,907
methyl 2-sulfanylacetate
COC(=O)CS
InChI=1S/C3H6O2S/c1-5-3(4)2-6/h6H,2H2,1H3
MKIJJIMOAABWGF-UHFFFAOYSA-N
C3H6O2S
106.15
106.008851
0.4
27.3
52
0
1
3
2
6
null
148 °C
0
1
1
1
0
0
0
1
1
0
0
0
0
0
0
0
1
1
0
1
BUTANOIC ACID, 3-METHYL-, 2-PROPENYL ESTER
002835-39-4
17,816
prop-2-enyl 3-methylbutanoate
CC(C)CC(=O)OCC=C
InChI=1S/C8H14O2/c1-4-5-10-8(9)6-7(2)3/h4,7H,1,5-6H2,2-3H3
HOMAGVUCNZNWBC-UHFFFAOYSA-N
C8H14O2
142.2
142.09938
2
26.3
116
0
0
2
5
10
103.5 °F (NTP, 1992)
306.1 °F at 729 mmHg (NTP, 1992)
0
1
0
1
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
TRIMETHYL PHOSPHITE
000121-45-9
8,472
trimethyl phosphite
COP(OC)OC
InChI=1S/C3H9O3P/c1-4-7(5-2)6-3/h1-3H3
CYTQBVOFDCPGCX-UHFFFAOYSA-N
C3H9O3P
124.08
124.028931
0.1
27.7
31
0
0
3
3
7
82 °F (USCG, 1999)
232 °F at 760 mmHg (USCG, 1999)
0
1
1
1
0
0
0
1
1
0
0
0
0
1
0
0
1
0
0
1
DIMETHYL HEXYNOL
000107-54-0
61,018
3,5-dimethylhex-1-yn-3-ol
CC(C)CC(C)(C#C)O
InChI=1S/C8H14O/c1-5-8(4,9)6-7(2)3/h1,7,9H,6H2,2-4H3
NECRQCBKTGZNMH-UHFFFAOYSA-N
C8H14O
126.2
126.104465
1.6
20.2
129
0
1
1
3
9
null
null
0
1
1
1
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
0
2-HEXENAL
000505-57-7
5,281,168
(E)-hex-2-enal
CCC/C=C/C=O
InChI=1S/C6H10O/c1-2-3-4-5-6-7/h4-6H,2-3H2,1H3/b5-4+
MBDOYVRWFFCFHM-SNAWJCMRSA-N
C6H10O
98.14
98.073165
1.5
17.1
64
0
0
1
3
7
null
47.00 °C. @ 17.00 mm Hg
0
1
0
1
0
0
1
1
1
0
0
0
0
0
0
0
0
1
0
0
N,N,N-TRIBUTYL-1-BUTANAMINIUM HYDROXIDE
002052-49-5
2,723,671
tetrabutylazanium hydroxide
CCCC[N+](CCCC)(CCCC)CCCC.[OH-]
InChI=1S/C16H36N.H2O/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;/h5-16H2,1-4H3;1H2/q+1;/p-1
VDZOOKBUILJEDG-UHFFFAOYSA-M
C16H37NO
259.47
259.287515
null
1
116
0
1
1
12
18
null
null
0
0
0
1
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
0
ACETIC ACID, MERCAPTO-, 2-ETHYLHEXYL ESTER
007659-86-1
24,309
2-ethylhexyl 2-sulfanylacetate
CCCCC(CC)COC(=O)CS
InChI=1S/C10H20O2S/c1-3-5-6-9(4-2)7-12-10(11)8-13/h9,13H,3-8H2,1-2H3
OWHSTLLOZWTNTQ-UHFFFAOYSA-N
C10H20O2S
204.33
204.118401
3.6
27.3
137
0
1
3
8
13
null
null
1
0
1
1
0
0
1
1
1
0
0
0
0
0
0
0
1
1
0
1
ISODODECANE
031807-55-3
23,459
2-methylundecane
CCCCCCCCCC(C)C
InChI=1S/C12H26/c1-4-5-6-7-8-9-10-11-12(2)3/h12H,4-11H2,1-3H3
GTJOHISYCKPIMT-UHFFFAOYSA-N
C12H26
170.33
170.203451
6.4
0
74
0
0
0
8
12
null
null
0
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
ETHANOL, 2-(1-METHYLETHOXY)-, ACETATE
019234-20-9
87,974
2-propan-2-yloxyethyl acetate
CC(C)OCCOC(=O)C
InChI=1S/C7H14O3/c1-6(2)9-4-5-10-7(3)8/h6H,4-5H2,1-3H3
HCDJVEYJSSTYSW-UHFFFAOYSA-N
C7H14O3
146.18
146.094294
0.8
35.5
99
0
0
3
5
10
null
null
0
0
0
1
0
0
1
0
1
0
0
0
0
0
0
0
0
0
1
0
OCTADECYLDIMETHYLAMINE
000124-28-7
15,365
N,N-dimethyloctadecan-1-amine
CCCCCCCCCCCCCCCCCCN(C)C
InChI=1S/C20H43N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)3/h4-20H2,1-3H3
NAPSCFZYZVSQHF-UHFFFAOYSA-N
C20H43N
297.6
297.33955
9.1
3.2
177
0
0
1
17
21
null
null
1
0
0
1
0
0
1
1
1
0
0
0
0
0
0
0
1
0
0
0
HEPTANOIC ACID, ETHYL ESTER
000106-30-9
7,797
ethyl heptanoate
CCCCCCC(=O)OCC
InChI=1S/C9H18O2/c1-3-5-6-7-8-9(10)11-4-2/h3-8H2,1-2H3
TVQGDYNRXLTQAP-UHFFFAOYSA-N
C9H18O2
158.24
158.13068
2.9
26.3
99
0
0
2
7
11
null
188.00 to 189.00 °C. @ 760.00 mm Hg
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
ISOBUTYL METHACRYLATE
000097-86-9
7,352
2-methylpropyl 2-methylprop-2-enoate
CC(C)COC(=O)C(=C)C
InChI=1S/C8H14O2/c1-6(2)5-10-8(9)7(3)4/h6H,3,5H2,1-2,4H3
RUMACXVDVNRZJZ-UHFFFAOYSA-N
C8H14O2
142.2
142.09938
2.7
26.3
136
0
0
2
4
10
120 °F (NTP, 1992)
311 °F at 760 mmHg (NTP, 1992)
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
1
1
0
1
BUTYL METHACRYLATE
000097-88-1
7,354
butyl 2-methylprop-2-enoate
CCCCOC(=O)C(=C)C
InChI=1S/C8H14O2/c1-4-5-6-10-8(9)7(2)3/h2,4-6H2,1,3H3
SOGAXMICEFXMKE-UHFFFAOYSA-N
C8H14O2
142.2
142.09938
2.9
26.3
127
0
0
2
5
10
126 °F (NTP, 1992)
326.3 to 338.9 °F at 760 mmHg (NTP, 1992)
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
1
0
1
N-BUTYL ALCOHOL
000071-36-3
263
butan-1-ol
CCCCO
InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3
LRHPLDYGYMQRHN-UHFFFAOYSA-N
C4H10O
74.12
74.073165
0.9
20.2
13
0
1
1
2
5
84 °F (USCG, 1999)
243.9 °F at 760 mmHg (USCG, 1999)
0
0
0
1
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
N,N'-DIISOPROPYLCARBODIIMIDE
000693-13-0
12,734
N,N'-di(propan-2-yl)methanediimine
CC(C)N=C=NC(C)C
InChI=1S/C7H14N2/c1-6(2)8-5-9-7(3)4/h6-7H,1-4H3
BDNKZNFMNDZQMI-UHFFFAOYSA-N
C7H14N2
126.2
126.115699
2.6
24.7
101
0
0
2
2
9
null
147 °C
1
0
1
0
0
0
1
1
1
0
0
0
0
0
1
0
1
1
0
1
CALCIUM 2-ETHYLHEXANOATE
000136-51-6
61,082
calcium bis(2-ethylhexanoate)
CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ca+2]
InChI=1S/2C8H16O2.Ca/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2
LTPCXXMGKDQPAO-UHFFFAOYSA-L
C16H30CaO4
326.48
326.177
null
80.3
93
0
0
4
8
21
null
null
0
0
0
1
0
0
1
1
1
0
0
0
0
1
1
0
1
1
0
1
PROPYLENE GLYCOL MONOMETHYL ETHER ACETATE
000108-65-6
7,946
1-methoxypropan-2-yl acetate
CC(COC)OC(=O)C
InChI=1S/C6H12O3/c1-5(4-8-3)9-6(2)7/h5H,4H2,1-3H3
LLHKCFNBLRBOGN-UHFFFAOYSA-N
C6H12O3
132.16
132.078644
0.4
35.5
90
0
0
3
4
9
114 °F (USCG, 1999)
302 °F at 760 mmHg (USCG, 1999)
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
HYDRAZINE MONOHYDRATE
007803-57-8
24,654
hydrazine;hydrate
NN.O
InChI=1S/H4N2.H2O/c1-2;/h1-2H2;1H2
IKDUDTNKRLTJSI-UHFFFAOYSA-N
H6N2O
50.061
50.048013
null
53
0
0
3
3
0
3
null
null
1
1
1
1
0
1
1
1
1
0
0
0
0
0
0
0
1
1
0
0
COBALT OCTOATE
000136-52-7
8,696
cobalt(2+);bis(2-ethylhexanoate)
CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Co+2]
InChI=1S/2C8H16O2.Co/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2
QAEKNCDIHIGLFI-UHFFFAOYSA-L
C16H30CoO4
345.34
345.147603
null
80.3
93
0
0
4
8
21
null
Decomposes at approximately 90 deg before boiling if heated in an aluminum crucible under nitrogen
1
0
0
1
0
0
1
1
1
0
0
0
0
1
0
0
1
1
0
0
2-PROPENOIC ACID, 2-METHYLPROPYL ESTER
000106-63-8
7,819
2-methylpropyl prop-2-enoate
CC(C)COC(=O)C=C
InChI=1S/C7H12O2/c1-4-7(8)9-5-6(2)3/h4,6H,1,5H2,2-3H3
CFVWNXQPGQOHRJ-UHFFFAOYSA-N
C7H12O2
128.17
128.08373
2.2
26.3
105
0
0
2
4
9
86 °F (NTP, 1992)
270 °F at 760 mmHg (NTP, 1992)
0
1
1
0
0
0
0
0
1
0
0
0
0
0
0
0
1
1
0
0
TRIPROPYLAMINE
000102-69-2
7,616
N,N-dipropylpropan-1-amine
CCCN(CCC)CCC
InChI=1S/C9H21N/c1-4-7-10(8-5-2)9-6-3/h4-9H2,1-3H3
YFTHZRPMJXBUME-UHFFFAOYSA-N
C9H21N
143.27
143.1674
2.8
3.2
47
0
0
1
6
10
98 °F (NTP, 1992)
313 °F at 760 mmHg (NTP, 1992)
0
1
1
1
0
0
1
1
1
0
0
0
0
0
0
0
1
0
0
1
ACETIC ACID ANHYDRIDE
000108-24-7
7,918
acetyl acetate
CC(=O)OC(=O)C
InChI=1S/C4H6O3/c1-3(5)7-4(2)6/h1-2H3
WFDIJRYMOXRFFG-UHFFFAOYSA-N
C4H6O3
102.09
102.031694
-0.1
43.4
83
0
0
3
2
7
121 °F (NTP, 1992)
283.19 °F at 760 mmHg (NTP, 1992)
0
0
1
1
0
0
0
0
1
0
0
0
0
0
0
0
1
0
0
0
2-DIMETHYLAMINOETHANOL
000108-01-0
7,902
2-(dimethylamino)ethanol
CN(C)CCO
InChI=1S/C4H11NO/c1-5(2)3-4-6/h6H,3-4H2,1-2H3
UEEJHVSXFDXPFK-UHFFFAOYSA-N
C4H11NO
89.14
89.084064
-0.4
23.5
28
0
1
2
2
6
105 °F (NTP, 1992)
275 °F at 758 mmHg (NTP, 1992)
0
1
1
1
0
0
0
0
1
0
0
0
0
0
0
0
1
0
0
0
N,N-DIMETHYL-1,3-PROPANEDIAMINE
000109-55-7
7,993
N',N'-dimethylpropane-1,3-diamine
CN(C)CCCN
InChI=1S/C5H14N2/c1-7(2)5-3-4-6/h3-6H2,1-2H3
IUNMPGNGSSIWFP-UHFFFAOYSA-N
C5H14N2
102.18
102.115699
-0.3
29.3
35
0
1
2
3
7
60 °F (NTP, 1992)
253 °F at 760 mmHg (NTP, 1992)
0
0
0
1
0
0
0
0
1
0
0
0
0
0
0
0
1
1
0
0
1,6-OCTADIENE, 7-METHYL-
042152-47-6
557,579
7-methylocta-1,6-diene
CC(=CCCCC=C)C
InChI=1S/C9H16/c1-4-5-6-7-8-9(2)3/h4,8H,1,5-7H2,2-3H3
UCKITPBQPGXDHV-UHFFFAOYSA-N
C9H16
124.22
124.125201
3.8
0
94
0
0
0
4
9
null
null
1
0
0
0
0
0
1
0
1
0
0
0
0
0
0
0
0
0
0
0
TERT-BUTYL DISULFIDE
000110-06-5
66,060
2-(tert-butyldisulfanyl)-2-methylpropane
CC(C)(C)SSC(C)(C)C
InChI=1S/C8H18S2/c1-7(2,3)9-10-8(4,5)6/h1-6H3
BKCNDTDWDGQHSD-UHFFFAOYSA-N
C8H18S2
178.4
178.084993
2.9
50.6
80
0
0
2
3
10
null
null
0
0
0
0
1
0
1
1
1
0
0
0
0
0
0
0
0
0
0
1
2-TERT-BUTYL-1,1,3,3-TETRAMETHYLGUANIDINE
029166-72-1
3,571,581
2-tert-butyl-1,1,3,3-tetramethylguanidine
CC(C)(C)N=C(N(C)C)N(C)C
InChI=1S/C9H21N3/c1-9(2,3)10-8(11(4)5)12(6)7/h1-7H3
YQHJFPFNGVDEDT-UHFFFAOYSA-N
C9H21N3
171.28
171.173548
0.8
18.8
153
0
0
1
3
12
null
null
0
0
0
1
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
0
3-TRIMETHYLSILYL-2-PROPYN-1-OL
005272-36-6
78,930
3-trimethylsilylprop-2-yn-1-ol
C[Si](C)(C)C#CCO
InChI=1S/C6H12OSi/c1-8(2,3)6-4-5-7/h7H,5H2,1-3H3
ZVGCJDPEKKEYES-UHFFFAOYSA-N
C6H12OSi
128.24
128.065742
null
20.2
120
0
1
1
1
8
null
null
0
0
0
1
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
1-PROPENE, 1,2,3-TRICHLORO-
000096-19-5
7,286
1,2,3-trichloroprop-1-ene
C(C(=CCl)Cl)Cl
InChI=1S/C3H3Cl3/c4-1-3(6)2-5/h1H,2H2
HIILBTHBHCLUER-UHFFFAOYSA-N
C3H3Cl3
145.41
143.930033
2.2
0
57
0
0
0
1
6
85 °C
142 °C
0
1
1
1
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
PENTANENITRILE, 2-AMINO-2,4-DIMETHYL-
026842-43-3
92,251
2-amino-2,4-dimethylpentanenitrile
CC(C)CC(C)(C#N)N
InChI=1S/C7H14N2/c1-6(2)4-7(3,9)5-8/h6H,4,9H2,1-3H3
PRTTZMKZMXANFG-UHFFFAOYSA-N
C7H14N2
126.2
126.115699
1
49.8
131
0
1
2
2
9
null
null
0
1
1
1
0
0
0
0
1
0
0
0
0
0
0
0
1
1
0
0
METHANESULFONIC ACID, TRIFLUORO-, 2-PROPYNYL ESTER
041029-46-3
3,084,814
prop-2-ynyl trifluoromethanesulfonate
C#CCOS(=O)(=O)C(F)(F)F
InChI=1S/C4H3F3O3S/c1-2-3-10-11(8,9)4(5,6)7/h1H,3H2
ROQYGSVHXLIXGO-UHFFFAOYSA-N
C4H3F3O3S
188.13
187.9755
1
51.8
261
0
0
6
2
11
null
null
0
0
1
1
0
0
0
0
1
0
0
0
0
0
0
0
1
0
0
0
PENTANENITRILE, 3-AMINO-
075405-06-0
93,451
3-aminopentanenitrile
CCC(CC#N)N
InChI=1S/C5H10N2/c1-2-5(7)3-4-6/h5H,2-3,7H2,1H3
FVPPLRDSFQDFLX-UHFFFAOYSA-N
C5H10N2
98.15
98.084398
-0.1
49.8
79
0
1
2
2
7
null
null
0
1
1
1
0
0
0
0
1
0
0
0
0
0
0
0
1
0
0
1
DIETHYL ETHYLMALONATE
000133-13-1
8,610
diethyl 2-ethylpropanedioate
CCC(C(=O)OCC)C(=O)OCC
InChI=1S/C9H16O4/c1-4-7(8(10)12-5-2)9(11)13-6-3/h7H,4-6H2,1-3H3
VQAZCUCWHIIFGE-UHFFFAOYSA-N
C9H16O4
188.22
188.104859
1.8
52.6
158
0
0
4
7
13
null
null
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
METHYL GLYCOLATE
000096-35-5
66,774
methyl 2-hydroxyacetate
COC(=O)CO
InChI=1S/C3H6O3/c1-6-3(5)2-4/h4H,2H2,1H3
GSJFXBNYJCXDGI-UHFFFAOYSA-N
C3H6O3
90.08
90.031694
-0.5
46.5
50
0
1
3
2
6
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
3-ETHOXYPROPIONITRILE
002141-62-0
16,501
3-ethoxypropanenitrile
CCOCCC#N
InChI=1S/C5H9NO/c1-2-7-5-3-4-6/h2-3,5H2,1H3
DCWQZPJHHVLHSV-UHFFFAOYSA-N
C5H9NO
99.13
99.068414
0.1
33
71
0
0
2
3
7
null
null
0
1
1
1
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
TERT-BUTYL-3-HYDROXYPROPIONATE
059854-11-4
16,218,743
tert-butyl 3-hydroxypropanoate
CC(C)(C)OC(=O)CCO
InChI=1S/C7H14O3/c1-7(2,3)10-6(9)4-5-8/h8H,4-5H2,1-3H3
NSXCURRVJMPAPA-UHFFFAOYSA-N
C7H14O3
146.18
146.094294
0.4
46.5
113
0
1
3
4
10
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
BUTANOIC ACID, 3-OXO-, BUTYL ESTER
000591-60-6
11,576
butyl 3-oxobutanoate
CCCCOC(=O)CC(=O)C
InChI=1S/C8H14O3/c1-3-4-5-11-8(10)6-7(2)9/h3-6H2,1-2H3
REIYHFWZISXFKU-UHFFFAOYSA-N
C8H14O3
158.19
158.094294
1.1
43.4
140
0
0
3
6
11
null
100.00 to 103.00 °C. @ 16.00 mm Hg
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
PROPANEDIOIC ACID, METHYL-, DIMETHYL ESTER
000609-02-9
69,104
dimethyl 2-methylpropanedioate
CC(C(=O)OC)C(=O)OC
InChI=1S/C6H10O4/c1-4(5(7)9-2)6(8)10-3/h4H,1-3H3
LRBPFPZTIZSOGG-UHFFFAOYSA-N
C6H10O4
146.14
146.057909
0.7
52.6
125
0
0
4
4
10
null
null
0
0
0
1
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
1,2-PROPANEDIOL, 1-ACETATE
000627-69-0
94,182
2-hydroxypropyl acetate
CC(COC(=O)C)O
InChI=1S/C5H10O3/c1-4(6)3-8-5(2)7/h4,6H,3H2,1-2H3
PPPFYBPQAPISCT-UHFFFAOYSA-N
C5H10O3
118.13
118.062994
-0.2
46.5
79
0
1
3
3
8
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
2-PENTANONE, 5-BROMO-
003884-71-7
77,493
5-bromopentan-2-one
CC(=O)CCCBr
InChI=1S/C5H9BrO/c1-5(7)3-2-4-6/h2-4H2,1H3
HTKABMPGOHRVCT-UHFFFAOYSA-N
C5H9BrO
165.03
163.98368
1
17.1
61
0
0
1
3
7
null
null
0
0
1
1
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
1,10-UNDECADIYNE
004117-15-1
77,764
undeca-1,10-diyne
C#CCCCCCCCC#C
InChI=1S/C11H16/c1-3-5-7-9-11-10-8-6-4-2/h1-2H,5-11H2
PZWZXAPXSJTOOI-UHFFFAOYSA-N
C11H16
148.24
148.125201
4.1
0
139
0
0
0
6
11
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
POLY[OXY(METHYL-1,2-ETHANEDIYL)], .ALPHA.-2-PROPENYL-.OMEGA.-HYDROXY-
009042-19-7
165,762
3-prop-2-enoxypropan-1-ol
C=CCOCCCO
InChI=1S/C6H12O2/c1-2-5-8-6-3-4-7/h2,7H,1,3-6H2
JTWOSPUWOVJQHH-UHFFFAOYSA-N
C6H12O2
116.16
116.08373
0.4
29.5
52
0
1
2
5
8
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
HEXANOIC ACID, 5-OXO-, METHYL ESTER
013984-50-4
84,129
methyl 5-oxohexanoate
CC(=O)CCCC(=O)OC
InChI=1S/C7H12O3/c1-6(8)4-3-5-7(9)10-2/h3-5H2,1-2H3
AVVPOKSKJSJVIX-UHFFFAOYSA-N
C7H12O3
144.17
144.078644
0.2
43.4
129
0
0
3
5
10
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
HEXANOIC ACID, 5-OXO-, ETHYL ESTER
013984-57-1
84,130
ethyl 5-oxohexanoate
CCOC(=O)CCCC(=O)C
InChI=1S/C8H14O3/c1-3-11-8(10)6-4-5-7(2)9/h3-6H2,1-2H3
MGPSIDGTLFKDEY-UHFFFAOYSA-N
C8H14O3
158.19
158.094294
0.4
43.4
140
0
0
3
6
11
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
PENTANOIC ACID, 4,4-DIMETHYL-3-OXO-, ETHYL ESTER
017094-34-7
86,950
ethyl 4,4-dimethyl-3-oxopentanoate
CCOC(=O)CC(=O)C(C)(C)C
InChI=1S/C9H16O3/c1-5-12-8(11)6-7(10)9(2,3)4/h5-6H2,1-4H3
VUYNTIDSHCJIKF-UHFFFAOYSA-N
C9H16O3
172.22
172.109944
1.6
43.4
177
0
0
3
5
12
null
null
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
2-BUTENOIC ACID, 3-METHYL-, 3-METHYLBUTYL ESTER
056922-73-7
92,570
3-methylbutyl 3-methylbut-2-enoate
CC(C)CCOC(=O)C=C(C)C
InChI=1S/C10H18O2/c1-8(2)5-6-12-10(11)7-9(3)4/h7-8H,5-6H2,1-4H3
DBGLRAHCYJTYEH-UHFFFAOYSA-N
C10H18O2
170.25
170.13068
3.2
26.3
165
0
0
2
5
12
null
197.00 to 199.00 °C. @ 760.00 mm Hg
0
0
0
0
0
0
0
1
1
0
0
0
0
0
0
0
1
0
0
1
IRON POWDER
007439-89-6
23,925
iron
[Fe]
InChI=1S/Fe
XEEYBQQBJWHFJM-UHFFFAOYSA-N
Fe
55.84
55.934936
null
0
0
0
0
0
0
1
null
2,861 °C
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
PHOSPHORUS (RED OR BLACK)
007723-14-0
5,462,309
phosphane
P
InChI=1S/P
OAICVXFJPJFONN-UHFFFAOYSA-N
P
30.973762
30.973762
null
0
0
0
0
0
0
1
null
536 °F at 760 mmHg ; white-yellow ignites at 86 °F in moist air; red ignites at 500 °F. (EPA, 1998)
0
0
0
0
0
0
1
0
0
1
0
0
0
0
0
0
0
0
0
0
DIMETHYLGLYOXIME
000095-45-4
135,459,645
N-(3-hydroxyiminobutan-2-ylidene)hydroxylamine
CC(=NO)C(=NO)C
InChI=1S/C4H8N2O2/c1-3(5-7)4(2)6-8/h7-8H,1-2H3
JGUQDUKBUKFFRO-UHFFFAOYSA-N
C4H8N2O2
116.12
116.058578
0.1
65.2
112
0
2
4
1
8
null
null
0
0
0
1
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
IRIDIUM METAL (SOLID)
007439-88-5
23,924
iridium
[Ir]
InChI=1S/Ir
GKOZUEZYRPOHIO-UHFFFAOYSA-N
Ir
192.22
192.96292
null
0
0
0
0
0
0
1
null
4,428 °C
0
0
0
0
0
0
1
1
0
1
0
0
0
0
0
0
0
0
0
0
CERIUM METAL
007440-45-1
23,974
cerium
[Ce]
InChI=1S/Ce
GWXLDORMOJMVQZ-UHFFFAOYSA-N
Ce
140.116
139.90545
null
0
0
0
0
0
0
1
null
null
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
SAMARIUM METAL
007440-19-9
23,951
samarium
[Sm]
InChI=1S/Sm
KZUNJOHGWZRPMI-UHFFFAOYSA-N
Sm
150.4
151.91974
null
0
0
0
0
0
0
1
null
1794 °C
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
GADOLINIUM METAL
007440-54-2
23,982
gadolinium
[Gd]
InChI=1S/Gd
UIWYJDYFSGRHKR-UHFFFAOYSA-N
Gd
157.25
157.92411
null
0
0
0
0
0
0
1
null
3273 °C
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
GERMANIUM METAL
007440-56-4
6,326,954
germanium
[Ge]
InChI=1S/Ge
GNPVGFCGXDBREM-UHFFFAOYSA-N
Ge
72.63
73.921178
null
0
0
0
0
0
0
1
null
2700 °C
0
0
0
0
0
0
1
0
0
1
0
0
0
1
0
0
0
0
1
0
LANTHANUM METAL
007439-91-0
23,926
lanthanum
[La]
InChI=1S/La
FZLIPJUXYLNCLC-UHFFFAOYSA-N
La
138.9055
138.906363
null
0
0
0
0
0
0
1
null
null
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
LUTETIUM METAL (POWDER)
007439-94-3
23,929
lutetium
[Lu]
InChI=1S/Lu
OHSVLFRHMCKCQY-UHFFFAOYSA-N
Lu
174.9667
174.94078
null
0
0
0
0
0
0
1
null
null
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
NEODYMIUM METAL
007440-00-8
23,934
neodymium
[Nd]
InChI=1S/Nd
QEFYFXOXNSNQGX-UHFFFAOYSA-N
Nd
144.24
141.90773
null
0
0
0
0
0
0
1
null
null
0
0
0
0
0
0
1
1
0
1
0
0
0
0
0
0
1
0
0
0
PINACOL
000076-09-5
6,425
2,3-dimethylbutane-2,3-diol
CC(C)(C(C)(C)O)O
InChI=1S/C6H14O2/c1-5(2,7)6(3,4)8/h7-8H,1-4H3
IVDFJHOHABJVEH-UHFFFAOYSA-N
C6H14O2
118.17
118.09938
0.1
40.5
72
0
2
2
1
8
null
null
0
0
0
0
0
0
0
1
0
1
0
0
0
0
0
0
1
0
0
1
PRASEODYMIUM METAL (POWDER)
007440-10-0
23,942
praseodymium
[Pr]
InChI=1S/Pr
PUDIUYLPXJFUGB-UHFFFAOYSA-N
Pr
140.90766
140.90766
null
0
0
0
0
0
0
1
null
null
0
0
0
0
0
0
1
1
0
1
0
0
0
0
0
0
1
0
0
0
RUTHENIUM METAL (POWDER)
007440-18-8
23,950
ruthenium
[Ru]
InChI=1S/Ru
KJTLSVCANCCWHF-UHFFFAOYSA-N
Ru
101.1
101.90434
null
0
0
0
0
0
0
1
null
null
0
0
0
0
0
0
1
0
0
1
0
0
0
0
0
0
0
0
0
0
TERBIUM METAL (SOLID)
007440-27-9
23,958
terbium
[Tb]
InChI=1S/Tb
GZCRRIHWUXGPOV-UHFFFAOYSA-N
Tb
158.92535
158.92535
null
0
0
0
0
0
0
1
null
null
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
ZIRCONIUM NITRIDE
025658-42-8
94,359
azanylidynezirconium
N#[Zr]
InChI=1S/N.Zr
ZVWKZXLXHLZXLS-UHFFFAOYSA-N
NZr
105.23
103.907773
null
23.8
10
0
0
1
0
2
null
null
0
0
0
0
0
0
0
1
0
1
0
0
0
0
0
0
1
0
0
1
OSMIUM METAL (POWDER)
007440-04-2
23,937
osmium
[Os]
InChI=1S/Os
SYQBFIAQOQZEGI-UHFFFAOYSA-N
Os
190.2
191.96148
null
0
0
0
0
0
0
1
null
5012 °C
0
0
0
0
0
0
1
1
0
1
0
0
0
0
0
0
1
0
0
1
DYSPROSIUM METAL (SOLID)
007429-91-6
23,912
dysprosium
[Dy]
InChI=1S/Dy
KBQHZAAAGSGFKK-UHFFFAOYSA-N
Dy
162.5
163.929181
null
0
0
0
0
0
0
1
null
null
0
0
0
0
0
0
1
1
0
1
0
0
0
0
0
0
1
0
0
0
HAFNIUM CARBIDE
012069-85-1
166,601
hafnium;methane
C.[Hf]
InChI=1S/CH4.Hf/h1H4;
WHJFNYXPKGDKBB-UHFFFAOYSA-N
CH4Hf
194.53
195.97786
null
0
0
0
0
0
0
2
null
null
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
SODIUM CYANOBOROHYDRIDE
025895-60-7
5,003,444
sodium cyanoboranuide
[BH3-]C#N.[Na+]
InChI=1S/CH3BN.Na/c2-1-3;/h2H3;/q-1;+1
CVDUGUOQTVTBJH-UHFFFAOYSA-N
CH3BNNa
62.84
63.025624
null
23.8
34
0
0
2
0
4
null
null
1
1
1
1
0
0
1
1
0
1
0
0
0
0
0
0
1
0
0
0
DYSPROSIUM NITRATE
010143-38-1
25,007
dysprosium(3+) trinitrate
[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Dy+3]
InChI=1S/Dy.3NO3/c;3*2-1(3)4/q+3;3*-1
DVENVBCPDCQQGD-UHFFFAOYSA-N
DyN3O9
348.52
349.892634
null
189
18
0
0
9
0
13
null
null
1
0
0
0
0
0
1
1
0
1
0
0
0
0
0
0
1
0
0
1
ALUMINUM ISOPROPOXIDE
000555-31-7
11,143
aluminum tris(propan-2-olate)
CC(C)[O-].CC(C)[O-].CC(C)[O-].[Al+3]
InChI=1S/3C3H7O.Al/c3*1-3(2)4;/h3*3H,1-2H3;/q3*-1;+3
SMZOGRDCAXLAAR-UHFFFAOYSA-N
C9H21AlO3
204.24
204.130608
null
69.2
10
0
0
3
0
13
null
135 °C @ 10 mm Hg; 131 °C @ 7.5 mm Hg; 125.5 °C @ 5.5 mm Hg; 113 °C @ 2.5 mm Hg; 106 °C @ 1.5 mm Hg; 94 °C @ 0.5 mm Hg
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
TITANIUM NITRIDE
025583-20-4
93,091
azanylidynetitanium
N#[Ti]
InChI=1S/N.Ti
NRTOMJZYCJJWKI-UHFFFAOYSA-N
NTi
61.874
61.951015
null
23.8
10
0
0
1
0
2
null
null
0
0
0
0
0
0
0
1
0
1
0
0
0
0
0
0
1
0
0
0
BIS(TRIMETHYLSILYL)SULFATE
018306-29-1
87,573
bis(trimethylsilyl) sulfate
C[Si](C)(C)OS(=O)(=O)O[Si](C)(C)C
InChI=1S/C6H18O4SSi2/c1-12(2,3)9-11(7,8)10-13(4,5)6/h1-6H3
KRUQDZRWZXUUAD-UHFFFAOYSA-N
C6H18O4SSi2
242.44
242.046433
null
61
232
0
0
4
4
13
null
null
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0