Ethyl 5-methyl-1-(4-nitrophenyl)-1H-1,2,4-triazole-3-carboxylate

CAS Registry Number®

15966-46-8
No image available.

CAS Name

Ethyl 5-methyl-1-(4-nitrophenyl)-1H-1,2,4-triazole-3-carboxylate

Molecular Formula

C12H12N4O4

Molecular Mass

276.25

Cite this Page

Ethyl 5-methyl-1-(4-nitrophenyl)-1H-1,2,4-triazole-3-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=15966-46-8 (retrieved 2024-08-17) (CAS RN: 15966-46-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    155-157 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H12N4O4/c1-3-20-12(17)11-13-8(2)15(14-11)9-4-6-10(7-5-9)16(18)19/h4-7H,3H2,1-2H3

InChIKey

InChIKey=VCTNAOBUERBFPF-UHFFFAOYSA-N

SMILES

CC=1N(N=C(C(OCC)=O)N1)C2=CC=C(N(=O)=O)C=C2

Canonical SMILES

O=C(OCC)C=1N=C(N(N1)C2=CC=C(C=C2)N(=O)=O)C

Other Names for this Substance

  • 1H-1,2,4-Triazole-3-carboxylic acid, 5-methyl-1-(4-nitrophenyl)-, ethyl ester
  • 1H-1,2,4-Triazole-3-carboxylic acid, 5-methyl-1-(p-nitrophenyl)-, ethyl ester
  • Ethyl 5-methyl-1-(4-nitrophenyl)-1H-1,2,4-triazole-3-carboxylate
  • 1-(4-Nitrophenyl)-3-ethoxycarbonyl-5-methyl-1,2,4-triazole