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1-[4-[(1-Methylethyl)thio]phenyl]-1-propanone

1-[4-[(1-Methylethyl)thio]phenyl]-1-propanone structure

CAS No:
69708-38-9
Formula:
C12H16OS
Chemical Name:
1-[4-[(1-Methylethyl)thio]phenyl]-1-propanone
Synonyms:
1-Propanone,1-[4-[(1-methylethyl)thio]phenyl]-;1-[4-[(1-Methylethyl)thio]phenyl]-1-propanone;p-(Isopropylthio)propiophenone;4′-(Isopropylthio)propiophenone;1-[4-(Propan-2-ylsulfanyl)phenyl]propan-1-one;1-(4-Propan-2-ylsulfanylphenyl)propan-1-one

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1-[4-[(1-Methylethyl)thio]phenyl]-1-propanone Basic Attributes

Molecular Weight：

208.32000

Exact Mass：

208.32

EC Number：

274-091-2

DSSTox ID：

DTXSID40219997

Characteristics

PSA：

42.37000

XLogP3：

3.77980

Density：

1.04g/cm3

Boiling Point：

321.2ºC

Flash Point：

157.7ºC

Refractive Index：

1.538

Computed Properties

Molecular Weight:208.32
XLogP3:3.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:208.09218630
Monoisotopic Mass:208.09218630
Topological Polar Surface Area:42.4
Heavy Atom Count:14
Complexity:181
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[4-[(1-Methylethyl)thio]phenyl]-1-propanone

Basic Attributes
Characteristics
Computed Properties

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