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3,3-Dimethyl-1-(methylthio)-2-butanone

3,3-Dimethyl-1-(methylthio)-2-butanone structure

CAS No:
39199-12-7
Formula:
C7H14OS
Chemical Name:
3,3-Dimethyl-1-(methylthio)-2-butanone
Synonyms:
2-Butanone,3,3-dimethyl-1-(methylthio)-;3,3-Dimethyl-1-(methylthio)-2-butanone;3,3-Dimethyl-1-methylthio-2-butanone;1-(Methylthio)pinacoline;3,3-Dimethyl-1-(methylsulfanyl)butan-2-one

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Description

3,3-dimethyl-1-(methylsulfanyl)butan-2-one is a butanone and an aliphatic sulfide.

3,3-Dimethyl-1-(methylthio)-2-butanone Basic Attributes

Molecular Weight：

146.25000

Exact Mass：

146.25

EC Number：

254-348-5

DSSTox ID：

DTXSID9068164

HScode：

2930909090

Characteristics

PSA：

42.37000

XLogP3：

1.96460

Density：

0.9489 g/cm³ @ Temp: 20 °C

Boiling Point：

73 °C @ Press: 13 Torr

Flash Point：

56.5ºC

Refractive Index：

1.459

3,3-Dimethyl-1-(methylthio)-2-butanone Use and Manufacturing

Manufacturing Info：

2-Butanone, 3,3-dimethyl-1-(methylthio)-: INACTIVE

Computed Properties

Molecular Weight:146.25
XLogP3:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:146.07653624
Monoisotopic Mass:146.07653624
Topological Polar Surface Area:42.4
Heavy Atom Count:9
Complexity:102
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,3-Dimethyl-1-(methylthio)-2-butanone

Description
Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

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