2-(3-Bromo-phenyl)-3-phenyl-propionitrile

HCID 59331981
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Basic information

Standard SMILES
N#CC(Cc1ccccc1)c1cccc(Br)c1
InChIKey
KBDGYEUBGBWOMC-UHFFFAOYSA-N
Molecular formula
C15H12BrN
Average molar mass
286.17 g/mol

Names & identifiers

Preferred name
2-(3-Bromo-phenyl)-3-phenyl-propionitrile
IUPAC
2-(3-bromophenyl)-3-phenylpropanenitrile

Names & synonyms

2-(3-Bromo-phenyl)-3-phenyl-propionitrile857530-78-02-(3-bromophenyl)-3-phenylpropanenitrileSCHEMBL1977958KBDGYEUBGBWOMC-UHFFFAOYSA-N2-(3-Bromophenyl)-3-phenylpropionitrileA1-28836

Database identifiers

PubChem CID
59331981

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
23.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
17

Related reactions

12 records
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Compound notes

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