2,6-Dimethylbenzeneacetonitrile

CAS Registry Number®

54708-14-4

CAS Name

2,6-Dimethylbenzeneacetonitrile

Molecular Formula

C10H11N

Molecular Mass

145.20

Cite this Page

2,6-Dimethylbenzeneacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=54708-14-4 (retrieved 2024-11-30) (CAS RN: 54708-14-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    44-58 °C @ Press: 0.5 Torr

  • Melting Point (1)

    39.5-40.5 °C

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=ABOLDLVTFQCAHP-UHFFFAOYSA-N

SMILES

C(C#N)C1=C(C)C=CC=C1C

Canonical SMILES

N#CCC=1C(=CC=CC1C)C

Other Names for this Substance

  • Benzeneacetonitrile, 2,6-dimethyl-
  • Acetonitrile, (2,6-xylyl)-
  • 2,6-Dimethylbenzeneacetonitrile
  • 2,6-Dimethylphenylacetonitrile
  • 2,6-Dimethylbenzyl cyanide

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