α-Butyl-4-chlorobenzeneacetonitrile

CAS Registry Number®

2124-74-5
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CAS Name

α-Butyl-4-chlorobenzeneacetonitrile

Molecular Formula

C12H14ClN

Molecular Mass

207.70

Cite this Page

α-Butyl-4-chlorobenzeneacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=2124-74-5 (retrieved 2024-05-02) (CAS RN: 2124-74-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    126-129 °C @ Press: 1.1 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H14ClN/c1-2-3-4-11(9-14)10-5-7-12(13)8-6-10/h5-8,11H,2-4H2,1H3

InChIKey

InChIKey=KENWYAZHACTWDC-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzeneacetonitrile, α-butyl-4-chloro-
  • Hexanenitrile, 2-(p-chlorophenyl)-
  • α-Butyl-4-chlorobenzeneacetonitrile
  • 2-(4-Chlorophenyl)hexanenitrile

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