3,5-Dinitrobenzoic acid

CAS Registry Number®

99-34-3

CAS Name

3,5-Dinitrobenzoic acid

Molecular Formula

C7H4N2O6

Molecular Mass

212.12

Cite this Page

3,5-Dinitrobenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=99-34-3 (retrieved 2024-11-21) (CAS RN: 99-34-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    205 °C

  • Density (2)

    1.498 g/cm³

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H4N2O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)

InChIKey

InChIKey=VYWYYJYRVSBHJQ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 3,5-dinitro-
  • 3,5-Dinitrobenzoic acid
  • 3-Carboxy-1,5-dinitrobenzene
  • DNBA
  • NSC 8732

Deleted or Replaced CAS Registry Numbers

64582-71-4, 73881-46-6

CAS INSIGHTSTM
Targeted protein degrader structure, illustration