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4-Acetyl-2-methylbenzonitrile

4-Acetyl-2-methylbenzonitrile structure

CAS No:
1138444-80-0
Formula:
C10H9NO
Chemical Name:
4-Acetyl-2-methylbenzonitrile
Synonyms:
4-ACETYL-2-METHYLBENZONITRILE;4"-Cyano-3"-methylacetophenone;1-(4-cyano-3-methylphenyl)ethanone;SCHEMBL2369495;CTK7C8183;ZINC35604910;AKOS006344304;AS05263;CM11174;1-(4-Cyano-3-methyl-phenyl)-ethanone

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4-Acetyl-2-methylbenzonitrile Basic Attributes

Molecular Weight：

159.18456

Exact Mass：

159.06800

Characteristics

PSA：

40.86000

XLogP3：

2.06928

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:159.18
XLogP3:1.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:159.068413911
Monoisotopic Mass:159.068413911
Topological Polar Surface Area:40.9
Heavy Atom Count:12
Complexity:225
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Acetyl-2-methylbenzonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-Acetyl-2-methylbenzonitrile

SDS

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