2-(5-Bromo-1H-1,2,4-triazol-3-yl)benzoic acid

CAS Registry Number®

1306738-32-8

CAS Name

2-(5-Bromo-1H-1,2,4-triazol-3-yl)benzoic acid

Molecular Formula

C9H6BrN3O2

Molecular Mass

268.07

Cite this Page

2-(5-Bromo-1H-1,2,4-triazol-3-yl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1306738-32-8 (retrieved 2024-11-22) (CAS RN: 1306738-32-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H6BrN3O2/c10-9-11-7(12-13-9)5-3-1-2-4-6(5)8(14)15/h1-4H,(H,14,15)(H,11,12,13)

InChIKey

InChIKey=QLBIIHDSISGRRD-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(C=CC=C1)C2=NN=C(Br)N2

Canonical SMILES

O=C(O)C=1C=CC=CC1C2=NN=C(Br)N2

Other Names for this Substance

  • Benzoic acid, 2-(5-bromo-1H-1,2,4-triazol-3-yl)-
  • 2-(5-Bromo-1H-1,2,4-triazol-3-yl)benzoic acid

CAS INSIGHTSTM
Targeted protein degrader structure, illustration