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5-Phenyl-2-azepanone

5-Phenyl-2-azepanone structure

CAS No:
7500-39-2
Formula:
C12H15NO
Chemical Name:
5-Phenyl-2-azepanone
Synonyms:
5-phenylazepan-2-one;5-Phenyl-2-azepanone;NSC400453;NSC 400453;5-phenyl-azepan-2-one;5-Phenylhexahydro-2-azepinone;SCHEMBL2937477;CTK5E0892;1667AC;Hexahydro-5-phenyl-2H-azepin-2-one

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5-Phenyl-2-azepanone Basic Attributes

Molecular Weight：

189.25400

Exact Mass：

189.11500

NSC Number：

400453

Characteristics

PSA：

29.10000

XLogP3：

2.39910

Density：

1.046 g/cm3

Boiling Point：

384.3ºC at 760 mmHg

Refractive Index：

1.526

Computed Properties

Molecular Weight:189.25
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:189.115364102
Monoisotopic Mass:189.115364102
Topological Polar Surface Area:29.1
Heavy Atom Count:14
Complexity:197
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Phenyl-2-azepanone

Basic Attributes
Characteristics
Computed Properties

5-Phenyl-2-azepanone

SDS

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