1-Chloro-4-isocyanato-2-nitrobenzene

CAS Registry Number®

40397-96-4
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CAS Name

1-Chloro-4-isocyanato-2-nitrobenzene

Molecular Formula

C7H3ClN2O3

Molecular Mass

198.56

Cite this Page

1-Chloro-4-isocyanato-2-nitrobenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=40397-96-4 (retrieved 2024-04-29) (CAS RN: 40397-96-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C7H3ClN2O3/c8-6-2-1-5(9-4-11)3-7(6)10(12)13/h1-3H

InChIKey

InChIKey=ZCPHLSPLEGBTCZ-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=CC(N=C=O)=CC=C1Cl

Canonical SMILES

O=C=NC1=CC=C(Cl)C(=C1)N(=O)=O

Other Names for this Substance

  • Benzene, 1-chloro-4-isocyanato-2-nitro-
  • Isocyanic acid, 4-chloro-3-nitrophenyl ester
  • 1-Chloro-4-isocyanato-2-nitrobenzene
  • 4-Chloro-3-nitrophenyl isocyanate
  • 3-Nitro-4-chlorophenyl isocyanate

CAS INSIGHTSTM
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