5-Cyano-1,3-benzenedicarboxylic acid

CAS Registry Number®

23341-13-1

CAS Name

5-Cyano-1,3-benzenedicarboxylic acid

Molecular Formula

C9H5NO4

Molecular Mass

191.14

Cite this Page

5-Cyano-1,3-benzenedicarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=23341-13-1 (retrieved 2024-12-22) (CAS RN: 23341-13-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    330 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H5NO4/c10-4-5-1-6(8(11)12)3-7(2-5)9(13)14/h1-3H,(H,11,12)(H,13,14)

InChIKey

InChIKey=YKADUTAIRWMMFI-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC=1C=C(C=C(C1)C(=O)O)C(=O)O

Other Names for this Substance

  • 1,3-Benzenedicarboxylic acid, 5-cyano-
  • Isophthalic acid, 5-cyano-
  • 5-Cyano-1,3-benzenedicarboxylic acid
  • 5-Cyanoisophthalic acid
  • 5-Cyanobenzene-1,3-dicarboxylic acid

CAS INSIGHTSTM
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