1H-Pyrazole-4-carboxylic acid, 5-(chlorosulfonyl)-1-methyl-, ethyl ester

CAS Registry Number®

88398-82-7
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CAS Name

1H-Pyrazole-4-carboxylic acid, 5-(chlorosulfonyl)-1-methyl-, ethyl ester

Molecular Formula

C7H9ClN2O4S

Molecular Mass

252.68

Cite this Page

1H-Pyrazole-4-carboxylic acid, 5-(chlorosulfonyl)-1-methyl-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=88398-82-7 (retrieved 2024-07-08) (CAS RN: 88398-82-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    95-97 °C @ Press: 1 Torr

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C7H9ClN2O4S/c1-3-14-7(11)5-4-9-10(2)6(5)15(8,12)13/h4H,3H2,1-2H3

InChIKey

InChIKey=BXPQVOSHELHKSE-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C1=C(S(Cl)(=O)=O)N(C)N=C1

Canonical SMILES

O=C(OCC)C=1C=NN(C1S(=O)(=O)Cl)C

Other Names for this Substance

  • 1H-Pyrazole-4-carboxylic acid, 5-(chlorosulfonyl)-1-methyl-, ethyl ester
  • Ethyl 5-(chlorosulfonyl)-1-methyl-1H-pyrazole-4-carboxylate