Vitas-M small molecule compound

1-(4-fluoro-2-nitrophenyl)-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole

Catalog ID
STK352034
SMILES Fc1ccc(c(c1)[N+](=O)[O-])n1nc(c2c1CCCC2)C(F)(F)F

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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 C14H11F4N3O2 MW 329.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11F4N3O2/c15-8-5-6-11(12(7-8)21(22)23)20-10-4-2-1-3-9(10)13(19-20)14(16,17)18/h5-7H,1-4H2
InChIKey
WMXHJLRVOZGRHM-UHFFFAOYSA-N
Synonyms
1018053-56-9
1(4fluoro2nitrophenyl)3(trifluoromethyl)4567tetrahydro1Hindazole
1(4fluoro2nitrophenyl)3(trifluoromethyl)4567tetrahydroindazole
1018053569
C1CCC2=C(C1)C(=NN2C3=C(C=C(C=C3)F)(N+)(=O)(O))C(F)(F)F
Fc1ccc(c(c1)(N+)(=O)(O))n1nc(c2c1CCCC2)C(F)(F)F
InChI=1SC14H11F4N3O2c1585611(12(78)21(22)23)201042139(10)13(1920)14(1617)18h57H14H2
MFCD09701694
ZINC000012396596
ZINC12396596

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.