Vitas-M small molecule compound
3-bromo-4-(4H-1,2,4-triazol-4-yl)benzoic acid
Catalog ID
STL431583
SMILES Brc1cc(ccc1n1cnnc1)C(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C9H6BrN3O2 MW 268.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H6BrN3O2/c10-7-3-6(9(14)15)1-2-8(7)13-4-11-12-5-13/h1-5H,(H,14,15)InChIKey
CCNSGQLKXFBZKO-UHFFFAOYSA-NSynonyms
3BROMO4(124TRIAZOL4YL)BENZOICACID
3bromo4(4H124triazol4yl)benzoicacid
C1=CC(=C(C=C1C(=O)O)Br)N2C=NN=C2
InChI=1SC9H6BrN3O2c10736(9(14)15)128(7)1341112513h15H(H1415)
MFCD12402391
ZINC000040457354
ZINC40457354
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