2,4-Dimethylbenzonitrile

CAS Registry Number®

21789-36-6

CAS Name

2,4-Dimethylbenzonitrile

Molecular Formula

C9H9N

Molecular Mass

131.17

Cite this Page

2,4-Dimethylbenzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=21789-36-6 (retrieved 2025-03-31) (CAS RN: 21789-36-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    114 °C @ Press: 20 Torr

  • Melting Point (2)

    23-25 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H9N/c1-7-3-4-9(6-10)8(2)5-7/h3-5H,1-2H3

InChIKey

InChIKey=QLZDTHTXOUOSCV-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC=C(C=C1C)C

Other Names for this Substance

  • Benzonitrile, 2,4-dimethyl-
  • 2,4-Dimethylbenzonitrile
  • 1-Cyano-2,4-dimethylbenzene

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