4-(4-Bromophenyl)-4,5-dihydro-1-(1-methylethyl)-5-oxo-1H-1,2,4-triazole-3-carboxylic acid

CAS Registry Number®

1427460-86-3

CAS Name

4-(4-Bromophenyl)-4,5-dihydro-1-(1-methylethyl)-5-oxo-1H-1,2,4-triazole-3-carboxylic acid

Molecular Formula

C12H12BrN3O3

Molecular Mass

326.15

Cite this Page

4-(4-Bromophenyl)-4,5-dihydro-1-(1-methylethyl)-5-oxo-1H-1,2,4-triazole-3-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1427460-86-3 (retrieved 2024-11-25) (CAS RN: 1427460-86-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H12BrN3O3/c1-7(2)16-12(19)15(10(14-16)11(17)18)9-5-3-8(13)4-6-9/h3-7H,1-2H3,(H,17,18)

InChIKey

InChIKey=FTAROCIOAZVGBU-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C1=NN(C(=O)N1C2=CC=C(Br)C=C2)C(C)C

Other Names for this Substance

  • 1H-1,2,4-Triazole-3-carboxylic acid, 4-(4-bromophenyl)-4,5-dihydro-1-(1-methylethyl)-5-oxo-
  • 4-(4-Bromophenyl)-4,5-dihydro-1-(1-methylethyl)-5-oxo-1H-1,2,4-triazole-3-carboxylic acid

CAS INSIGHTSTM
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