4-Ethyl-β-oxobenzenepropanenitrile

CAS Registry Number®

96220-15-4

CAS Name

4-Ethyl-β-oxobenzenepropanenitrile

Molecular Formula

C11H11NO

Molecular Mass

173.21

Cite this Page

4-Ethyl-β-oxobenzenepropanenitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=96220-15-4 (retrieved 2024-11-24) (CAS RN: 96220-15-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    102-103 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H11NO/c1-2-9-3-5-10(6-4-9)11(13)7-8-12/h3-6H,2,7H2,1H3

InChIKey

InChIKey=WIHQQWBHEUCYCJ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzenepropanenitrile, 4-ethyl-β-oxo-
  • 4-Ethyl-β-oxobenzenepropanenitrile
  • 3-(4-Ethylphenyl)-3-oxopropanenitrile

CAS INSIGHTSTM
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