3,4-Dichlorobenzeneacetonitrile

CAS Registry Number®

3218-49-3
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CAS Name

3,4-Dichlorobenzeneacetonitrile

Molecular Formula

C8H5Cl2N

Molecular Mass

186.04

Cite this Page

3,4-Dichlorobenzeneacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3218-49-3 (retrieved 2024-09-06) (CAS RN: 3218-49-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    170 °C @ Press: 12 Torr

  • Melting Point (2)

    41-42 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H5Cl2N/c9-7-2-1-6(3-4-11)5-8(7)10/h1-2,5H,3H2

InChIKey

InChIKey=QWZNCAFWRZZJMA-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzeneacetonitrile, 3,4-dichloro-
  • Acetonitrile, (3,4-dichlorophenyl)-
  • 3,4-Dichlorobenzeneacetonitrile
  • (3,4-Dichlorophenyl)acetonitrile
  • 3,4-Dichlorobenzyl cyanide

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