4-Iodo-1,5-dimethyl-1H-pyrazole-3-carboxylic acid

CAS Registry Number®

6647-95-6

CAS Name

4-Iodo-1,5-dimethyl-1H-pyrazole-3-carboxylic acid

Molecular Formula

C6H7IN2O2

Molecular Mass

266.04

Cite this Page

4-Iodo-1,5-dimethyl-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=6647-95-6 (retrieved 2024-11-23) (CAS RN: 6647-95-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    234-235 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H7IN2O2/c1-3-4(7)5(6(10)11)8-9(3)2/h1-2H3,(H,10,11)

InChIKey

InChIKey=LLKCKWLAENNHOZ-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C(I)=C(C)N(C)N1

Canonical SMILES

O=C(O)C1=NN(C(=C1I)C)C

Other Names for this Substance

  • 1H-Pyrazole-3-carboxylic acid, 4-iodo-1,5-dimethyl-
  • Pyrazole-3-carboxylic acid, 4-iodo-1,5-dimethyl-
  • 4-Iodo-1,5-dimethyl-1H-pyrazole-3-carboxylic acid

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