3-Methyl-2-butanethiol
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3-Methyl-2-butanethiol
structure -
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CAS No:
2084-18-6
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Formula:
C5H12S
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Chemical Name:
3-Methyl-2-butanethiol
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Synonyms:
2-Butanethiol,3-methyl-;3-Methyl-2-butanethiol;110503-17-8
- Categories:
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CAS No:
Description
3-Methyl-1-butanethiol has a repulsive, characteristic mercaptan-like odor. Colorless liquid; offensive odor.Insoluble in water; soluble in organic solvents.
colourless liquid with repulsive, mercaptan-like odour
3-Methyl-2-butanethiol is an alkanethiol.
Characteristics
1
2.47
colourless liquid with repulsive, mercaptan-like odour
0.841
-109.95°C (estimate)
109-112 °C(lit.)
60 °F
1.444
insoluble in water, miscible with alcohol and ether
36.7mmHg at 25°C
Safety Information
II
3
UN 3336 3/PG 2
3
11
16-33-36-24/25
F
P210
H225
Flammable - 3rd degree
|Danger|H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 1567 companies from 4 notifications to the ECHA C&L Inventory.
3-Methyl-2-butanethiol Use and Manufacturing
Polymerization modifier, insecticide intermediate, vulcanization accelerator intermediate, nonionic surface-active agent.
2-Butanethiol, 3-methyl-: ACTIVE
Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index|Fire Hazards -> Flammable - 3rd degree
Flavoring Agents
Computed Properties
Molecular Weight:104.22
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:104.06597156
Monoisotopic Mass:104.06597156
Topological Polar Surface Area:1
Heavy Atom Count:6
Complexity:32.9
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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