Vitas-M small molecule compound
3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one
Catalog ID
STK311015
SMILES O=C(N1N=CCC1(O)C(F)(F)F)CCn1nc(c(c1C)[N+](=O)[O-])C
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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 C12H14F3N5O4 MW 349.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14F3N5O4/c1-7-10(20(23)24)8(2)18(17-7)6-3-9(21)19-11(22,4-5-16-19)12(13,14)15/h5,22H,3-4,6H2,1-2H3InChIKey
FVVYNLXRYOCWKX-UHFFFAOYSA-NSynonyms
1005658-78-51005658785
3(35dimethyl4nitro1Hpyrazol1yl)1(5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)propan1one
3(35dimethyl4nitropyrazol1yl)1(5hydroxy5(trifluoromethyl)4Hpyrazol1yl)propan1one
CC1=C(C(=NN1CCC(=O)N2C(CC=N2)(C(F)(F)F)O)C)(N+)(=O)(O)
InChI=1SC12H14F3N5O4c1710(20(23)24)8(2)18(177)639(21)1911(22451619)12(1314)15h522H346H212H3
MFCD04058877
O=C(N1N=CCC1(O)C(F)(F)F)CCn1nc(c(c1C)(N+)(=O)(O))C
ZINC000006526301
ZINC000006526312
Check stock
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