Vitas-M small molecule compound

1-(3-fluorophenyl)-5-methyl-1H-1,2,4-triazole-3-carboxylic acid

Catalog ID
STK694414
SMILES Fc1cccc(c1)n1nc(nc1C)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 C10H8FN3O2 MW 221.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H8FN3O2/c1-6-12-9(10(15)16)13-14(6)8-4-2-3-7(11)5-8/h2-5H,1H3,(H,15,16)
InChIKey
XWXJHADOMOYFPR-UHFFFAOYSA-N
Synonyms
948007-65-6
1(3FLUOROPHENYL)5METHYL124TRIAZOLE3CARBOXYLICACID
1(3FLUOROPHENYL)5METHYL1H(124)TRIAZOLE3CARBOXYLICACID
1(3fluorophenyl)5methyl1H124triazole3carboxylicacid
948007656
CC1=NC(=NN1C2=CC(=CC=C2)F)C(=O)O
InChI=1SC10H8FN3O2c16129(10(15)16)1314(6)84237(11)58h25H1H3(H1516)
MFCD10037602
ZINC000014988054
ZINC14988054

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.