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1-(2-Methylphenyl)-1-butanone

1-(2-Methylphenyl)-1-butanone structure

CAS No:
35028-06-9
Formula:
C11H14O
Chemical Name:
1-(2-Methylphenyl)-1-butanone
Synonyms:
1-Butanone,1-(2-methylphenyl)-;Butyrophenone,2′-methyl-;1-(2-Methylphenyl)-1-butanone;Propyl o-tolyl ketone;2′-Methylbutyrophenone

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1-(2-Methylphenyl)-1-butanone Basic Attributes

Molecular Weight：

162.22800

Exact Mass：

162.23

EC Number：

252-323-3

DSSTox ID：

DTXSID70188546

HScode：

2914399090

Characteristics

PSA：

17.07000

XLogP3：

2.97780

Density：

0.9774 g/cm³ @ Temp: 20 °C

Boiling Point：

84-85 °C @ Press: 2 Torr

Flash Point：

106.4ºC

Refractive Index：

1.503

Computed Properties

Molecular Weight:162.23
XLogP3:2.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:162.104465066
Monoisotopic Mass:162.104465066
Topological Polar Surface Area:17.1
Heavy Atom Count:12
Complexity:151
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(2-Methylphenyl)-1-butanone

Basic Attributes
Characteristics
Computed Properties

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