4-Methoxy-2-methyl-2-butanethiol
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4-Methoxy-2-methyl-2-butanethiol
structure -
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CAS No:
94087-83-9
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Formula:
C6H14OS
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Chemical Name:
4-Methoxy-2-methyl-2-butanethiol
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Synonyms:
2-Butanethiol,4-methoxy-2-methyl-;4-Methoxy-2-methyl-2-butanethiol;2-Mercapto-4-methoxy-2-methylbutane
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CAS No:
4-Methoxy-2-methyl-2-butanethiol Basic Attributes
134.24
134.24
301-977-9
X72J2YFL9Y
DTXSID9052634
2930909090
Characteristics
10.2
1.73130
0.906g/cm3
159.1ºC at 760mmHg
50ºC
1.445
2263 mg/L @ 25 °C (est)|insoluble in water; soluble in ethanol
Safety Information
UN 1993C 3 / PGIII
P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P303+P361+P353, P330, P370+P378, P403+P235, P501
H226
|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P303+P361+P353, P330, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 1442 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
4-Methoxy-2-methyl-2-butanethiol Use and Manufacturing
2-Butanethiol, 4-methoxy-2-methyl-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents
Computed Properties
Molecular Weight:134.24
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:134.07653624
Monoisotopic Mass:134.07653624
Topological Polar Surface Area:10.2
Heavy Atom Count:8
Complexity:61.5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-Methoxy-2-methyl-2-butanethiol
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