4-Methylbenzonitrile

CAS Registry Number®

104-85-8

CAS Name

4-Methylbenzonitrile

Molecular Formula

C8H7N

Molecular Mass

117.15

Cite this Page

4-Methylbenzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=104-85-8 (retrieved 2024-11-23) (CAS RN: 104-85-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    217 °C

  • Melting Point (1)

    29.5 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C8H7N/c1-7-2-4-8(6-9)5-3-7/h2-5H,1H3

InChIKey

InChIKey=VCZNNAKNUVJVGX-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzonitrile, 4-methyl-
  • p-Tolunitrile
  • 4-Methylbenzonitrile
  • p-Methylbenzonitrile
  • p-Tolylnitrile

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