1-(1,1-Dimethylethyl)-3-methyl-1H-pyrazole-4-carboxylic acid

CAS Registry Number®

113100-47-3
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CAS Name

1-(1,1-Dimethylethyl)-3-methyl-1H-pyrazole-4-carboxylic acid

Molecular Formula

C9H14N2O2

Molecular Mass

182.22

Cite this Page

1-(1,1-Dimethylethyl)-3-methyl-1H-pyrazole-4-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=113100-47-3 (retrieved 2024-08-07) (CAS RN: 113100-47-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H14N2O2/c1-6-7(8(12)13)5-11(10-6)9(2,3)4/h5H,1-4H3,(H,12,13)

InChIKey

InChIKey=YKVWUVSWHUEXMJ-UHFFFAOYSA-N

SMILES

C(C)(C)(C)N1C=C(C(O)=O)C(C)=N1

Canonical SMILES

O=C(O)C1=CN(N=C1C)C(C)(C)C

Other Names for this Substance

  • 1H-Pyrazole-4-carboxylic acid, 1-(1,1-dimethylethyl)-3-methyl-
  • 1-(1,1-Dimethylethyl)-3-methyl-1H-pyrazole-4-carboxylic acid
  • 1-tert-Butyl-3-methyl-1H-pyrazole-4-carboxylic acid