Ethyl 5-amino-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate

CAS Registry Number®

123419-06-7

CAS Name

Ethyl 5-amino-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate

Molecular Formula

C12H11F3N4O2

Molecular Mass

300.24

Cite this Page

Ethyl 5-amino-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=123419-06-7 (retrieved 2024-09-30) (CAS RN: 123419-06-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    135 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C12H11F3N4O2/c1-2-21-11(20)9-10(16)19(18-17-9)8-5-3-4-7(6-8)12(13,14)15/h3-6H,2,16H2,1H3

InChIKey

InChIKey=PECHXUOMMZEJEU-UHFFFAOYSA-N

SMILES

NC=1N(N=NC1C(OCC)=O)C2=CC(C(F)(F)F)=CC=C2

Canonical SMILES

O=C(OCC)C=1N=NN(C2=CC=CC(=C2)C(F)(F)F)C1N

Other Names for this Substance

  • 1H-1,2,3-Triazole-4-carboxylic acid, 5-amino-1-[3-(trifluoromethyl)phenyl]-, ethyl ester
  • Ethyl 5-amino-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate

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