Benzoylacetonitrile

CAS Registry Number®

614-16-4

CAS Name

Benzoylacetonitrile

Molecular Formula

C9H7NO

Molecular Mass

145.16

Cite this Page

Benzoylacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=614-16-4 (retrieved 2024-11-21) (CAS RN: 614-16-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    160 °C @ Press: 10 Torr

  • Melting Point (2)

    80.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H7NO/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5H,6H2

InChIKey

InChIKey=ZJRCIQAMTAINCB-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CCC(=O)C=1C=CC=CC1

Other Names for this Substance

  • Benzenepropanenitrile, β-oxo-
  • Acetonitrile, benzoyl-
  • β-Oxobenzenepropanenitrile
  • ω-Cyanoacetophenone
  • Benzoylacetonitrile

View All

Deleted or Replaced CAS Registry Numbers

151887-87-5

CAS INSIGHTSTM
Targeted protein degrader structure, illustration