Vitas-M small molecule compound
1-[4-chloro-3-(trifluoromethyl)phenyl]-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STL143185
SMILES COCc1c(nnn1c1ccc(c(c1)C(F)(F)F)Cl)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 C12H9ClF3N3O3 MW 335.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9ClF3N3O3/c1-22-5-9-10(11(20)21)17-18-19(9)6-2-3-8(13)7(4-6)12(14,15)16/h2-4H,5H2,1H3,(H,20,21)InChIKey
FALHWGWVJDFZOA-UHFFFAOYSA-NSynonyms
1351844-81-91(4chloro3(trifluoromethyl)phenyl)5(methoxymethyl)1H123triazole4carboxylicacid
1(4chloro3(trifluoromethyl)phenyl)5(methoxymethyl)triazole4carboxylicacid
1351844819
COCC1=C(N=NN1C2=CC(=C(C=C2)Cl)C(F)(F)F)C(=O)O
InChI=1SC12H9ClF3N3O3c1225910(11(20)21)171819(9)6238(13)7(46)12(1415)16h24H5H21H3(H2021)
MFCD20748310
ZINC000071327492
ZINC71327492
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