2,5-Dimethylbenzeneacetonitrile

CAS Registry Number®

16213-85-7

CAS Name

2,5-Dimethylbenzeneacetonitrile

Molecular Formula

C10H11N

Molecular Mass

145.20

Cite this Page

2,5-Dimethylbenzeneacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=16213-85-7 (retrieved 2024-12-04) (CAS RN: 16213-85-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    88-90 °C @ Press: 1.7 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H11N/c1-8-3-4-9(2)10(7-8)5-6-11/h3-4,7H,5H2,1-2H3

InChIKey

InChIKey=HCELORQTHSKCQL-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CCC1=CC(=CC=C1C)C

Other Names for this Substance

  • Benzeneacetonitrile, 2,5-dimethyl-
  • Acetonitrile, (2,5-xylyl)-
  • 2,5-Dimethylbenzeneacetonitrile
  • 2,5-Dimethylphenylacetonitrile
  • 2,5-Dimethylbenzyl cyanide

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