3-Methyl-4-nitro-1-propyl-1H-pyrazole-5-carboxylic acid

CAS Registry Number®

39658-17-8
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CAS Name

3-Methyl-4-nitro-1-propyl-1H-pyrazole-5-carboxylic acid

Molecular Formula

C8H11N3O4

Molecular Mass

213.19

Cite this Page

3-Methyl-4-nitro-1-propyl-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=39658-17-8 (retrieved 2024-09-07) (CAS RN: 39658-17-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H11N3O4/c1-3-4-10-7(8(12)13)6(11(14)15)5(2)9-10/h3-4H2,1-2H3,(H,12,13)

InChIKey

InChIKey=GHKGNQDAOKQDDM-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(N(=O)=O)C(C)=NN1CCC

Canonical SMILES

O=C(O)C1=C(C(=NN1CCC)C)N(=O)=O

Other Names for this Substance

  • 1H-Pyrazole-5-carboxylic acid, 3-methyl-4-nitro-1-propyl-
  • 3-Methyl-4-nitro-1-propyl-1H-pyrazole-5-carboxylic acid
  • 5-Methyl-4-nitro-2-propyl-2H-pyrazole-3-carboxylic acid