Vitas-M small molecule compound
1-benzyl-5-chloro-1H-1,2,4-triazole-3-carboxylic acid
Catalog ID
STL423752
SMILES OC(=O)c1nn(c(n1)Cl)Cc1ccccc1
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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 C10H8ClN3O2 MW 237.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H8ClN3O2/c11-10-12-8(9(15)16)13-14(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,15,16)InChIKey
GJXQCBFRUQITFG-UHFFFAOYSA-NSynonyms
1807979-67-41807979674
1benzyl5chloro124triazole3carboxylicacid
1benzyl5chloro1H124triazole3carboxylicacid
C1=CC=C(C=C1)CN2C(=NC(=N2)C(=O)O)Cl
InChI=1SC10H8ClN3O2c1110128(9(15)16)1314(10)67421357h15H6H2(H1516)
MFCD28954601
ZINC000242495575
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