Vitas-M small molecule compound
[4-(difluoromethoxy)-3-methoxyphenyl][5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Catalog ID
STL178282
SMILES COc1cc(ccc1OC(F)F)C(=O)N1N=CCC1(O)C(F)(F)F
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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 C13H11F5N2O4 MW 354.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11F5N2O4/c1-23-9-6-7(2-3-8(9)24-11(14)15)10(21)20-12(22,4-5-19-20)13(16,17)18/h2-3,5-6,11,22H,4H2,1H3InChIKey
NGWQBHAZCUPFJR-UHFFFAOYSA-NSynonyms
832147-34-9(4(difluoromethoxy)3methoxyphenyl)(5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)methanone
(4(difluoromethoxy)3methoxyphenyl)(5hydroxy5(trifluoromethyl)4Hpyrazol1yl)methanone
832147349
COC1=C(C=CC(=C1)C(=O)N2C(CC=N2)(C(F)(F)F)O)OC(F)F
InChI=1SC13H11F5N2O4c123967(238(9)2411(14)15)10(21)2012(22451920)13(1617)18h23561122H4H21H3
MFCD04138231
ZINC000006641890
ZINC000006641894
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