Vitas-M small molecule compound
[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl](3-methyl-4-nitrophenyl)methanone
Catalog ID
STK431509
SMILES FC(C1=NN(C(C1)(O)C(F)F)C(=O)c1ccc(c(c1)C)[N+](=O)[O-])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 C13H11F4N3O4 MW 349.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11F4N3O4/c1-6-4-7(2-3-9(6)20(23)24)11(21)19-13(22,12(16)17)5-8(18-19)10(14)15/h2-4,10,12,22H,5H2,1H3InChIKey
LUYFPVWIBFIAJK-UHFFFAOYSA-NSynonyms
(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(3methyl4nitrophenyl)methanone
(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)(3METHYL4NITROPHENYL)METHANONE
35BIS(DIFLUOROMETHYL)1((3METHYL4NITROPHENYL)CARBONYL)45DIHYDRO1HPYRAZOL5OL
35BIS(DIFLUOROMETHYL)5HYDROXY(2PYRAZOLINYL)3METHYL4NITROPHENYLKETONE
CC1=C(C=CC(=C1)C(=O)N2C(CC(=N2)C(F)F)(C(F)F)O)(N+)(=O)(O)
FC(C1=NN(C(C1)(O)C(F)F)C(=O)c1ccc(c(c1)C)(N+)(=O)(O))F
InChI=1SC13H11F4N3O4c1647(239(6)20(23)24)11(21)1913(2212(16)17)58(1819)10(14)15h24101222H5H21H3
MFCD03466256
ZINC000000204501
ZINC000000204503
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