Vitas-M small molecule compound
1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-nitro-1H-pyrazol-1-yl)ethanone
Catalog ID
STK311200
SMILES O=C(N1N=CCC1(O)C(F)(F)F)Cn1ncc(c1)[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 C9H8F3N5O4 MW 307.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8F3N5O4/c10-9(11,12)8(19)1-2-13-16(8)7(18)5-15-4-6(3-14-15)17(20)21/h2-4,19H,1,5H2InChIKey
YPWJQLHRBZJPAG-UHFFFAOYSA-NSynonyms
1005570-95-51(5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)2(4nitro1Hpyrazol1yl)ethanone
1(5hydroxy5(trifluoromethyl)4Hpyrazol1yl)2(4nitropyrazol1yl)ethanone
1005570955
C1C=NN(C1(C(F)(F)F)O)C(=O)CN2C=C(C=N2)(N+)(=O)(O)
InChI=1SC9H8F3N5O4c109(1112)8(19)121316(8)7(18)51546(31415)17(20)21h2419H15H2
MFCD04059377
O=C(N1N=CCC1(O)C(F)(F)F)Cn1ncc(c1)(N+)(=O)(O)
ZINC000006828463
ZINC000006828469
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