Ethyl 1-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylate

CAS Registry Number®

112055-36-4

CAS Name

Ethyl 1-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylate

Molecular Formula

C13H10ClF3N2O2

Molecular Mass

318.68

Cite this Page

Ethyl 1-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=112055-36-4 (retrieved 2024-12-02) (CAS RN: 112055-36-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    51-53 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C13H10ClF3N2O2/c1-2-21-12(20)10-7-18-19(11(10)13(15,16)17)9-5-3-8(14)4-6-9/h3-7H,2H2,1H3

InChIKey

InChIKey=AXOBLWLBBFCXOG-UHFFFAOYSA-N

SMILES

C(F)(F)(F)C=1N(N=CC1C(OCC)=O)C2=CC=C(Cl)C=C2

Canonical SMILES

O=C(OCC)C=1C=NN(C2=CC=C(Cl)C=C2)C1C(F)(F)F

Other Names for this Substance

  • 1H-Pyrazole-4-carboxylic acid, 1-(4-chlorophenyl)-5-(trifluoromethyl)-, ethyl ester
  • Ethyl 1-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylate
  • 1-(4-Chlorophenyl)-5-trifluoromethyl-1H-pyrazole-4-carboxylic acid ethyl ester

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