1-[(3,5-Dimethylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid

CAS Registry Number®

1004193-21-8

CAS Name

1-[(3,5-Dimethylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid

Molecular Formula

C13H14N2O3

Molecular Mass

246.26

Cite this Page

1-[(3,5-Dimethylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1004193-21-8 (retrieved 2024-12-05) (CAS RN: 1004193-21-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H14N2O3/c1-9-5-10(2)7-11(6-9)18-8-15-4-3-12(14-15)13(16)17/h3-7H,8H2,1-2H3,(H,16,17)

InChIKey

InChIKey=BJDDSMALJBAIRJ-UHFFFAOYSA-N

SMILES

C(OC1=CC(C)=CC(C)=C1)N2N=C(C(O)=O)C=C2

Canonical SMILES

O=C(O)C1=NN(C=C1)COC=2C=C(C=C(C2)C)C

Other Names for this Substance

  • 1H-Pyrazole-3-carboxylic acid, 1-[(3,5-dimethylphenoxy)methyl]-
  • 1-[(3,5-Dimethylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid

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