4-Chloro-3-nitrobenzoic acid

96-99-1

CAS Name

4-Chloro-3-nitrobenzoic acid

Molecular Formula

C₇H₄ClNO₄

Molecular Mass

201.56

Compound Properties

• Melting Point (1)

  182.8 °C

• Density (2)

  1.687 g/cm³

Source(s)

• (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
• (2) Ferguson, G.; Acta Crystallographica, (1959), 12, 941, CAplus

Other Names and Identifiers

InChI

InChI=1S/C7H4ClNO4/c8-5-2-1-4(7(10)11)3-6(5)9(12)13/h1-3H,(H,10,11)

InChIKey

InChIKey=DFXQXFGFOLXAPO-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=CC(C(O)=O)=CC=C1Cl

Canonical SMILES

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

Other Names for this Substance