3-Chloro-3-(4-nitrophenyl)-2-propenenitrile

CAS Registry Number®

78583-88-7
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CAS Name

3-Chloro-3-(4-nitrophenyl)-2-propenenitrile

Molecular Formula

C9H5ClN2O2

Molecular Mass

208.60

Cite this Page

3-Chloro-3-(4-nitrophenyl)-2-propenenitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=78583-88-7 (retrieved 2024-06-20) (CAS RN: 78583-88-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    126-130 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C9H5ClN2O2/c10-9(5-6-11)7-1-3-8(4-2-7)12(13)14/h1-5H

InChIKey

InChIKey=PWJDADFQYZTUAQ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 2-Propenenitrile, 3-chloro-3-(4-nitrophenyl)-
  • 3-Chloro-3-(4-nitrophenyl)-2-propenenitrile

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