γ-Oxo-α-phenylbenzenebutanenitrile

CAS Registry Number®

6268-00-4
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CAS Name

γ-Oxo-α-phenylbenzenebutanenitrile

Molecular Formula

C16H13NO

Molecular Mass

235.28

Cite this Page

γ-Oxo-α-phenylbenzenebutanenitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6268-00-4 (retrieved 2024-07-01) (CAS RN: 6268-00-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    126-127 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H13NO/c17-12-15(13-7-3-1-4-8-13)11-16(18)14-9-5-2-6-10-14/h1-10,15H,11H2

InChIKey

InChIKey=JRWUFQJVJGKCCT-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC(C=1C=CC=CC1)CC(=O)C=2C=CC=CC2

Other Names for this Substance

  • Benzenebutanenitrile, γ-oxo-α-phenyl-
  • Hydratroponitrile, β-benzoyl-
  • γ-Oxo-α-phenylbenzenebutanenitrile
  • 2-Phenyl-3-benzoylpropionitrile
  • α-Phenyl-β-benzoylpropionitrile

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Deleted or Replaced CAS Registry Numbers

77670-32-7