2,4,6-Trimethylbenzeneacetonitrile

CAS Registry Number®

34688-71-6

CAS Name

2,4,6-Trimethylbenzeneacetonitrile

Molecular Formula

C11H13N

Molecular Mass

159.23

Cite this Page

2,4,6-Trimethylbenzeneacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=34688-71-6 (retrieved 2024-11-24) (CAS RN: 34688-71-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    150-155 °C @ Press: 15 Torr

  • Melting Point (1)

    79 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H13N/c1-8-6-9(2)11(4-5-12)10(3)7-8/h6-7H,4H2,1-3H3

InChIKey

InChIKey=SDKQOGSGNPGPRN-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzeneacetonitrile, 2,4,6-trimethyl-
  • Acetonitrile, mesityl-
  • 2,4,6-Trimethylbenzeneacetonitrile
  • 2,4,6-Trimethylbenzyl cyanide
  • (2,4,6-Trimethylphenyl)acetonitrile

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