Vitas-M small molecule compound
1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-(3-nitro-1H-pyrazol-1-yl)propan-1-one
Catalog ID
STK311267
SMILES O=C(N1N=CCC1(O)C(F)(F)F)CCn1ccc(n1)[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 C10H10F3N5O4 MW 321.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10F3N5O4/c11-10(12,13)9(20)3-4-14-17(9)8(19)2-6-16-5-1-7(15-16)18(21)22/h1,4-5,20H,2-3,6H2InChIKey
WPKBIGCLQFPYOC-UHFFFAOYSA-NSynonyms
1005659-39-11(5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)3(3nitro1Hpyrazol1yl)propan1one
1(5hydroxy5(trifluoromethyl)4Hpyrazol1yl)3(3nitropyrazol1yl)propan1one
1005659391
C1C=NN(C1(C(F)(F)F)O)C(=O)CCN2C=CC(=N2)(N+)(=O)(O)
InChI=1SC10H10F3N5O4c1110(1213)9(20)341417(9)8(19)2616517(1516)18(21)22h14520H236H2
MFCD04059700
O=C(N1N=CCC1(O)C(F)(F)F)CCn1ccc(n1)(N+)(=O)(O)
ZINC000006829975
ZINC000006829976
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