1-(1-Methylethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

CAS Registry Number®

1006950-68-0

CAS Name

1-(1-Methylethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

Molecular Formula

C7H9N3O4

Molecular Mass

199.16

Cite this Page

1-(1-Methylethyl)-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=1006950-68-0 (retrieved 2025-01-04) (CAS RN: 1006950-68-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C7H9N3O4/c1-4(2)9-5(7(11)12)3-6(8-9)10(13)14/h3-4H,1-2H3,(H,11,12)

InChIKey

InChIKey=ORAAYBGNOUMNMD-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 1H-Pyrazole-5-carboxylic acid, 1-(1-methylethyl)-3-nitro-
  • 1-(1-Methylethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
  • 2-Isopropyl-5-nitro-2H-pyrazole-3-carboxylic acid
  • 1-Isopropyl-3-nitro-1H-pyrazole-5-carboxylic acid
  • 3-Nitro-1-(propan-2-yl)-1H-pyrazole-5-carboxylic acid

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