(3-Cyanomethyl-5-methylphenyl)acetonitrile

CAS Registry Number®

120511-74-2
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CAS Name

(3-Cyanomethyl-5-methylphenyl)acetonitrile

Molecular Formula

C11H10N2

Molecular Mass

170.21

Cite this Page

(3-Cyanomethyl-5-methylphenyl)acetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=120511-74-2 (retrieved 2024-04-29) (CAS RN: 120511-74-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    224-225 °C @ Press: 14 Torr

  • Melting Point (1)

    73 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H10N2/c1-9-6-10(2-4-12)8-11(7-9)3-5-13/h6-8H,2-3H2,1H3

InChIKey

InChIKey=XJCXEUYJQHPEAE-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 1,3-Benzenediacetonitrile, 5-methyl-
  • 5-Methyl-1,3-benzenediacetonitrile
  • 5-Methylbenzene-1,3-diacetonitrile
  • (3-Cyanomethyl-5-methylphenyl)acetonitrile

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