Methyl 4-chloro-3-isocyanobenzoate

CAS Registry Number®

730971-37-6
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CAS Name

Methyl 4-chloro-3-isocyanobenzoate

Molecular Formula

C9H6ClNO2

Cite this Page

Methyl 4-chloro-3-isocyanobenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=730971-37-6 (retrieved 2024-09-06) (CAS RN: 730971-37-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H6ClNO2/c1-11-8-5-6(9(12)13-2)3-4-7(8)10/h3-5H,2H3

InChIKey

InChIKey=CLBCJFDAXHTAIV-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=CC([N+]#[C-])=C(Cl)C=C1

Canonical SMILES

[C-]#[N+]C1=CC(=CC=C1Cl)C(=O)OC

Other Names for this Substance

  • Benzoic acid, 4-chloro-3-isocyano-, methyl ester
  • Methyl 4-chloro-3-isocyanobenzoate