3,3-dimethyl-1-(methylthio)butan-2-one

Modify Date: 2025-09-15 17:59:54

3,3-dimethyl-1-(methylthio)butan-2-one Structure
3,3-dimethyl-1-(methylthio)butan-2-one structure
Common Name 3,3-dimethyl-1-(methylthio)butan-2-one
CAS Number 39199-12-7 Molecular Weight 146.25000
Density 0.942g/cm3 Boiling Point 182.7ºC at 760 mmHg
Molecular Formula C7H14OS Melting Point N/A
MSDS N/A Flash Point 56.5ºC

 Names

Name 3,3-dimethyl-1-(methylsulfanyl)butan-2-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.942g/cm3
Boiling Point 182.7ºC at 760 mmHg
Molecular Formula C7H14OS
Molecular Weight 146.25000
Flash Point 56.5ºC
Exact Mass 146.07700
PSA 42.37000
LogP 1.96460
Index of Refraction 1.459
InChIKey MHHUUPYWCAKNBW-UHFFFAOYSA-N
SMILES CSCC(=O)C(C)(C)C

 Safety Information

HS Code 2930909090

 Synthetic Route

~76%

3,3-dimethyl-1-(methylthio)butan-2-one Structure

3,3-dimethyl-1-...

CAS#:39199-12-7

Literature: Brunet, E.; Garcia-Ruano, J. L.; Rodriguez, J. H.; Alcudia, F. Tetrahedron, 1984 , vol. 40, # 21 p. 4433 - 4445

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3,3-dimethyl-1-(methylthio)butan-2-one Structure

3,3-dimethyl-1-...

CAS#:39199-12-7

Literature: Asinger et al. Justus Liebigs Annalen der Chemie, 1958 , vol. 619, p. 145,157

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3,3-dimethyl-1-(methylthio)butan-2-one Structure

3,3-dimethyl-1-...

CAS#:39199-12-7

Literature: Asinger et al. Justus Liebigs Annalen der Chemie, 1958 , vol. 619, p. 145,157

 Customs

HS Code 2930909090
Summary 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

2-Butanone,3,3-dimethyl-1-(methylthio)
3,3-dimethyl-1-(methylthio)butan-2-one
3,3-dimethyl-1-methylsulfanylbutan-2-one
EINECS 254-348-5
3,3-Dimethyl-1-methylmercapto-butan-2-on
3,3-Dimethyl-1-methylthio-2-butanone
3,3-dimethyl-1-methylsulfanyl-butan-2-one
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