4-Chloro-1-methyl-3-nitro-1H-pyrazole-5-carboxylic acid

CAS Registry Number®

84547-88-6

CAS Name

4-Chloro-1-methyl-3-nitro-1H-pyrazole-5-carboxylic acid

Molecular Formula

C5H4ClN3O4

Molecular Mass

205.56

Cite this Page

4-Chloro-1-methyl-3-nitro-1H-pyrazole-5-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=84547-88-6 (retrieved 2024-11-25) (CAS RN: 84547-88-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    151-152 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C5H4ClN3O4/c1-8-3(5(10)11)2(6)4(7-8)9(12)13/h1H3,(H,10,11)

InChIKey

InChIKey=ZIBFUEQMNQITNU-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(Cl)C(N(=O)=O)=NN1C

Canonical SMILES

O=C(O)C1=C(Cl)C(=NN1C)N(=O)=O

Other Names for this Substance

  • 1H-Pyrazole-5-carboxylic acid, 4-chloro-1-methyl-3-nitro-
  • 4-Chloro-1-methyl-3-nitro-1H-pyrazole-5-carboxylic acid
  • 4-Chloro-1-methyl-5-pyrazolecarboxylic acid

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