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2-(2-Oxopropyl)benzonitrile

2-(2-Oxopropyl)benzonitrile structure

CAS No:
73013-48-6
Formula:
C10H9NO
Chemical Name:
2-(2-Oxopropyl)benzonitrile
Synonyms:
Benzonitrile,2-(2-oxopropyl)-;2-(2-Oxopropyl)benzonitrile;(o-Cyano-phenyl) acetone

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2-(2-Oxopropyl)benzonitrile Basic Attributes

Molecular Weight：

159.18 g/mol

Exact Mass：

159.18

DSSTox ID：

DTXSID30363695

Characteristics

PSA：

40.9 Å²

Melting Point：

28-29 °C

Boiling Point：

120-122 °C @ Press: 5 Torr

Computed Properties

Molecular Weight:159.18
XLogP3:1.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:159.068413911
Monoisotopic Mass:159.068413911
Topological Polar Surface Area:40.9
Heavy Atom Count:12
Complexity:213
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: methanol structure; cyclobutane; albendazole; acetylacetone; formaldehyde; glibenclamide

Guide of 2-(2-Oxopropyl)benzonitrile

Basic Attributes
Characteristics
Computed Properties

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