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4-Chloro-1-(2,5-dimethylphenyl)-1-butanone

4-Chloro-1-(2,5-dimethylphenyl)-1-butanone structure

CAS No:
71526-84-6
Formula:
C12H15ClO
Chemical Name:
4-Chloro-1-(2,5-dimethylphenyl)-1-butanone
Synonyms:
1-Butanone,4-chloro-1-(2,5-dimethylphenyl)-;Butyrophenone,4-chloro-2′,5′-dimethyl-;4-Chloro-1-(2,5-dimethylphenyl)-1-butanone;4-Chloro-2′,5′-dimethylbutyrophenone;NSC 163131;2′,5′-Dimethyl-4-chlorobutyrophenone

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4-Chloro-1-(2,5-dimethylphenyl)-1-butanone Basic Attributes

Molecular Weight：

210.6999

Exact Mass：

210.70

EC Number：

275-598-1

NSC Number：

163131

DSSTox ID：

DTXSID50221768

Characteristics

PSA：

17.1

XLogP3：

3.50510

Density：

1.064g/cm3

Boiling Point：

142-148 °C @ Press: 7 Torr

Flash Point：

179.8ºC

Refractive Index：

1.518

Computed Properties

Molecular Weight:210.70
XLogP3:3.2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:210.0811428
Monoisotopic Mass:210.0811428
Topological Polar Surface Area:17.1
Heavy Atom Count:14
Complexity:191
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Chloro-1-(2,5-dimethylphenyl)-1-butanone

Basic Attributes
Characteristics
Computed Properties

4-Chloro-1-(2,5-dimethylphenyl)-1-butanone

SDS

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