2-Nitro-1,3-benzenedicarboxylic acid

CAS Registry Number®

21161-11-5

CAS Name

2-Nitro-1,3-benzenedicarboxylic acid

Molecular Formula

C8H5NO6

Molecular Mass

211.13

Cite this Page

2-Nitro-1,3-benzenedicarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=21161-11-5 (retrieved 2024-11-21) (CAS RN: 21161-11-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    300 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H5NO6/c10-7(11)4-2-1-3-5(8(12)13)6(4)9(14)15/h1-3H,(H,10,11)(H,12,13)

InChIKey

InChIKey=CAHWDGJDQYAFHM-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=C(C(O)=O)C=CC=C1C(O)=O

Canonical SMILES

O=C(O)C1=CC=CC(C(=O)O)=C1N(=O)=O

Other Names for this Substance

  • 1,3-Benzenedicarboxylic acid, 2-nitro-
  • 2-Nitro-1,3-benzenedicarboxylic acid
  • 2-Nitroisophthalic acid
  • 3-Carboxy-2-nitrobenzoic acid
  • 2,6-Dicarboxy-1-nitrobenzene

CAS INSIGHTSTM
Targeted protein degrader structure, illustration