Methyl 5-(1,1-dimethylethyl)-1-phenyl-1H-pyrazole-3-carboxylate

CAS Registry Number®

1322605-01-5
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CAS Name

Methyl 5-(1,1-dimethylethyl)-1-phenyl-1H-pyrazole-3-carboxylate

Molecular Formula

C15H18N2O2

Molecular Mass

258.32

Cite this Page

Methyl 5-(1,1-dimethylethyl)-1-phenyl-1H-pyrazole-3-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1322605-01-5 (retrieved 2024-09-06) (CAS RN: 1322605-01-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H18N2O2/c1-15(2,3)13-10-12(14(18)19-4)16-17(13)11-8-6-5-7-9-11/h5-10H,1-4H3

InChIKey

InChIKey=VCFCBBMQBIPCGL-UHFFFAOYSA-N

SMILES

C(C)(C)(C)C=1N(N=C(C(OC)=O)C1)C2=CC=CC=C2

Canonical SMILES

O=C(OC)C1=NN(C=2C=CC=CC2)C(=C1)C(C)(C)C

Other Names for this Substance

  • 1H-Pyrazole-3-carboxylic acid, 5-(1,1-dimethylethyl)-1-phenyl-, methyl ester
  • Methyl 5-(1,1-dimethylethyl)-1-phenyl-1H-pyrazole-3-carboxylate
  • 1-Phenyl-5-tert-butyl-pyrazol-3-carboxylic acid methyl ester