4-Chloro-α,3,5-trimethyl-1H-pyrazole-1-acetic acid

CAS Registry Number®

956950-98-4

CAS Name

4-Chloro-α,3,5-trimethyl-1H-pyrazole-1-acetic acid

Molecular Formula

C8H11ClN2O2

Molecular Mass

202.64

Cite this Page

4-Chloro-α,3,5-trimethyl-1H-pyrazole-1-acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=956950-98-4 (retrieved 2024-11-25) (CAS RN: 956950-98-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H11ClN2O2/c1-4-7(9)5(2)11(10-4)6(3)8(12)13/h6H,1-3H3,(H,12,13)

InChIKey

InChIKey=ZFBIVBZRAMXENI-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C(N1N=C(C(Cl)=C1C)C)C

Other Names for this Substance

  • 1H-Pyrazole-1-acetic acid, 4-chloro-α,3,5-trimethyl-
  • 4-Chloro-α,3,5-trimethyl-1H-pyrazole-1-acetic acid

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