2-[3-(3-Bromophenyl)-1-oxopropyl]benzonitrile

CAS Registry Number®

898782-09-7
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CAS Name

2-[3-(3-Bromophenyl)-1-oxopropyl]benzonitrile

Molecular Formula

C16H12BrNO

Molecular Mass

314.18

Cite this Page

2-[3-(3-Bromophenyl)-1-oxopropyl]benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=898782-09-7 (retrieved 2024-08-22) (CAS RN: 898782-09-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H12BrNO/c17-14-6-3-4-12(10-14)8-9-16(19)15-7-2-1-5-13(15)11-18/h1-7,10H,8-9H2

InChIKey

InChIKey=JYDAIUSXIVCARN-UHFFFAOYSA-N

SMILES

C(CCC1=CC(Br)=CC=C1)(=O)C2=C(C#N)C=CC=C2

Canonical SMILES

N#CC=1C=CC=CC1C(=O)CCC=2C=CC=C(Br)C2

Other Names for this Substance

  • Benzonitrile, 2-[3-(3-bromophenyl)-1-oxopropyl]-
  • 2-[3-(3-Bromophenyl)-1-oxopropyl]benzonitrile