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3,3-dimethyl-6-oxo-6-phenylhexanenitrile

3,3-dimethyl-6-oxo-6-phenylhexanenitrile structure

CAS No:
62623-62-5
Formula:
C14H17NO
Chemical Name:
3,3-dimethyl-6-oxo-6-phenylhexanenitrile
Synonyms:
3,3-Dimethyl-6-oxo-6-phenylhexanenitrile;CHEBI:167325;Benzenehexanenitrile, .beta.,.beta.-dimethyl-.epsilon.-oxo-;3,3-Dimethyl-6-oxo-6-phenylhexanenitrile #;beta,beta-Dimethyl-epsilon-oxobenzenehexanenitrile;Benzenehexanenitrile, beta,beta-dimethyl-epsilon-oxo-;62623-62-5

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Description

Benzenehexanenitrile, beta,beta-dimethyl-epsilon-oxo- is an aromatic ketone.

3,3-dimethyl-6-oxo-6-phenylhexanenitrile Basic Attributes

Molecular Weight：

215.29 g/mol

Exact Mass：

215.131014166 g/mol

Characteristics

PSA：

40.9 Å²

XLogP3：

3.58938

Melting Point：

54.5 - 55.5 °C (hexane)

Computed Properties

Molecular Weight:215.29
XLogP3:2.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:215.131014166
Monoisotopic Mass:215.131014166
Topological Polar Surface Area:40.9
Heavy Atom Count:16
Complexity:278
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,3-dimethyl-6-oxo-6-phenylhexanenitrile

Description
Basic Attributes
Characteristics
Computed Properties

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