Benzoic acid, 2-cyano-5-iodo-, methyl ester

CAS Registry Number®

58332-00-6

CAS Name

Benzoic acid, 2-cyano-5-iodo-, methyl ester

Molecular Formula

C9H6INO2

Molecular Mass

287.05

Cite this Page

Benzoic acid, 2-cyano-5-iodo-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=58332-00-6 (retrieved 2024-11-29) (CAS RN: 58332-00-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H6INO2/c1-13-9(12)8-4-7(10)3-2-6(8)5-11/h2-4H,1H3

InChIKey

InChIKey=FTMUDTOUHNUCRP-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=C(C#N)C=CC(I)=C1

Canonical SMILES

N#CC1=CC=C(I)C=C1C(=O)OC

Other Names for this Substance

  • Benzoic acid, 2-cyano-5-iodo-, methyl ester
  • Methyl 2-cyano-5-iodobenzoate

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