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3-[2-(3-methylphenyl)-2-oxoethyl]benzonitrile

3-[2-(3-methylphenyl)-2-oxoethyl]benzonitrile structure

CAS No:
59483-72-6
Formula:
C16H13NO
Chemical Name:
3-[2-(3-methylphenyl)-2-oxoethyl]benzonitrile
Synonyms:
59483-72-6;3-[2-(3-methylphenyl)-2-oxoethyl]benzonitrile;NSC278000;DTXSID40313863;ZINC1562868;NSC-278000

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3-[2-(3-methylphenyl)-2-oxoethyl]benzonitrile Basic Attributes

Molecular Weight：

235.28 g/mol

Exact Mass：

235.099714038 g/mol

NSC Number：

278000

DSSTox ID：

DTXSID40313863

Characteristics

PSA：

40.9 Å²

Computed Properties

Molecular Weight:235.28
XLogP3:3.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:235.099714038
Monoisotopic Mass:235.099714038
Topological Polar Surface Area:40.9
Heavy Atom Count:18
Complexity:340
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[2-(3-methylphenyl)-2-oxoethyl]benzonitrile

Basic Attributes
Characteristics
Computed Properties

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