4,4'-((1H-1,2,4-Triazol-1-yl)methylene)dibenzoic acid

  • CAT Number: L004022
  • CAS Number: 1644566-39-1
  • Molecular Formula: C17H13N3O4
  • Molecular Weight: 323.3
  • Purity: ≥95%
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4,4′-((1H-1,2,4-Triazol-1-yl)methylene)dibenzoic acid (Cat.No:L004022) is a significant chemical compound in pharmaceutical research. Its unique structure, incorporating a 1,2,4-triazole ring, offers versatile reactivity. This compound serves as a crucial scaffold in the development of bioactive molecules, particularly in the field of pharmaceuticals.


Catalog Number L004022
CAS Number 1644566-39-1
Molecular Formula C17H13N3O4
Purity ≥95%
IUPAC Name 4-[(4-carboxyphenyl)-(1,2,4-triazol-1-yl)methyl]benzoic acid
InChI InChI=1S/C17H13N3O4/c21-16(22)13-5-1-11(2-6-13)15(20-10-18-9-19-20)12-3-7-14(8-4-12)17(23)24/h1-10,15H,(H,21,22)(H,23,24)
InChIKey OMYQMDBEDMTHOJ-UHFFFAOYSA-N
SMILES C1=CC(=CC=C1C(C2=CC=C(C=C2)C(=O)O)N3C=NC=N3)C(=O)O

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