Vitas-M small molecule compound
[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](3-nitrophenyl)methanone
Catalog ID
STK877305
SMILES O=C(N1N=C(CC1(O)C(C)(C)C)C(F)(F)F)c1cccc(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 C15H16F3N3O4 MW 359.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16F3N3O4/c1-13(2,3)14(23)8-11(15(16,17)18)19-20(14)12(22)9-5-4-6-10(7-9)21(24)25/h4-7,23H,8H2,1-3H3InChIKey
JXEAKAOITUFUJE-UHFFFAOYSA-NSynonyms
(5(tertbutyl)5hydroxy3(trifluoromethyl)45dihydro1Hpyrazol1yl)(3nitrophenyl)methanone
(5tertbutyl5hydroxy3(trifluoromethyl)45dihydro1Hpyrazol1yl)(3nitrophenyl)methanone
(5TERTBUTYL5HYDROXY3(TRIFLUOROMETHYL)4HPYRAZOL1YL)(3NITROPHENYL)METHANONE
CC(C)(C)C1(CC(=NN1C(=O)C2=CC(=CC=C2)(N+)(=O)(O))C(F)(F)F)O
InChI=1SC15H16F3N3O4c113(23)14(23)811(15(1617)18)1920(14)12(22)954610(79)21(24)25h4723H8H213H3
MFCD01203515
O=C(N1N=C(CC1(O)C(C)(C)C)C(F)(F)F)c1cccc(c1)(N+)(=O)(O)
ZINC000001212657
ZINC000001212658
Check stock
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