4-Cyanophenylacetonitrile

CAS Registry Number®

876-31-3
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CAS Name

4-Cyanophenylacetonitrile

Molecular Formula

C9H6N2

Molecular Mass

142.16

Cite this Page

4-Cyanophenylacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=876-31-3 (retrieved 2024-08-19) (CAS RN: 876-31-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    142-143 °C @ Press: 1 Torr

  • Melting Point (2)

    102-104.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H6N2/c10-6-5-8-1-3-9(7-11)4-2-8/h1-4H,5H2

InChIKey

InChIKey=QILKKAFYAFEWGU-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC=C(C=C1)CC#N

Other Names for this Substance

  • Benzeneacetonitrile, 4-cyano-
  • p-Tolunitrile, α-cyano-
  • 4-Cyanobenzeneacetonitrile
  • p-Cyanobenzylcyanide
  • α-Cyano-p-tolunitrile

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