3,4-Dimethylbenzeneacetonitrile

CAS Registry Number®

3020-06-2

CAS Name

3,4-Dimethylbenzeneacetonitrile

Molecular Formula

C10H11N

Molecular Mass

145.20

Cite this Page

3,4-Dimethylbenzeneacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3020-06-2 (retrieved 2024-11-24) (CAS RN: 3020-06-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    635 °C @ Press: 0.5 Torr

  • Melting Point (2)

    35-38 °C

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=XNSHCUIBMZSUGL-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CCC1=CC=C(C(=C1)C)C

Other Names for this Substance

  • Benzeneacetonitrile, 3,4-dimethyl-
  • Acetonitrile, 3,4-xylyl-
  • 3,4-Dimethylbenzeneacetonitrile
  • 3,4-Xylylacetonitrile
  • 3,4-Dimethylbenzyl cyanide

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