Vitas-M small molecule compound
1-[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-nitrophenoxy)propan-1-one
Catalog ID
STK443533
SMILES CC(C(=O)N1N=C(CC1(O)C(F)F)C(F)F)Oc1ccc(cc1)[N+](=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 C14H13F4N3O5 MW 379.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13F4N3O5/c1-7(26-9-4-2-8(3-5-9)21(24)25)12(22)20-14(23,13(17)18)6-10(19-20)11(15)16/h2-5,7,11,13,23H,6H2,1H3InChIKey
MWLTUKNWGHMOHI-UHFFFAOYSA-NSynonyms
1(35BIS(DIFLUOROMETHYL)5HYDROXY(2PYRAZOLINYL))2(4NITROPHENOXY)PROPAN1ONE
1(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)2(4nitrophenoxy)propan1one
1(35bis(difluoromethyl)5hydroxy4Hpyrazol1yl)2(4nitrophenoxy)propan1one
CC(C(=O)N1C(CC(=N1)C(F)F)(C(F)F)O)OC2=CC=C(C=C2)(N+)(=O)(O)
CC(C(=O)N1N=C(CC1(O)C(F)F)C(F)F)Oc1ccc(cc1)(N+)(=O)(O)
InChI=1SC14H13F4N3O5c17(269428(359)21(24)25)12(22)2014(2313(17)18)610(1920)11(15)16h257111323H6H21H3
MFCD04054814
ZINC000006520680
ZINC000006524209
Check stock
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Check stock on Vitas-MAvailable files
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