3-(3-Bromophenyl)-3-oxopropanenitrile structure

3-(3-Bromophenyl)-3-oxopropanenitrile

3-(3-bromophenyl)-3-oxopropanenitrile

Also Known As: 3-Bromobenzoylacetonitrile|3-(3-bromophenyl)-3-oxopropanenitrile|2-(3-bromobenzoyl)-acetonitrile|BUTTPARK 35\09-89|3'-BROMOBENZOYLACETONITRILE|2-(3-BROMOBENZOYL)ACETONITRILE|3-Bromo-b-oxo-benzenepropanenitrile|Benzenepropanenitrile,3-bromo-b-oxo-|CL8855|3-bromo-beta-oxo-benzenepropanenitrile|3-oxo-3-(3-bromophenyl)propionitrile|3-(3-Bromo-phenyl)-3-oxo-propionitr|3-Oxo-3-(3-bromophenyl)propanenitrile|3-(3-bromo-phenyl)-3-oxo-propionitrile|3-(3-bromophenyl)-3-oxo-propanenitrile

CAS: 70591-86-5
Molecular Formula C9H6BrNO
Molecular Weight 222.96329 g/mol
LogP 2.54548
Topological Polar Surface Area 40.86 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 2
Exact Mass 222.96329
Monoisotopic Mass 222.96329
Heavy Atoms 12
Complexity 340.62692

Chemical Identifiers

CAS Number 70591-86-5
SMILES C1=CC(=CC(=C1)Br)C(=O)CC#N

Product Overview

3-(3-Bromophenyl)-3-oxopropanenitrile (CAS 70591-86-5), with molecular formula C9H6BrNO and molecular weight 222.96329 g/mol. IUPAC: 3-(3-bromophenyl)-3-oxopropanenitrile.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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3-(3-Bromophenyl)-3-oxopropanenitrile is a custom synthesis product. We offer services from milligram to kilogram scale.

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