Vitas-M small molecule compound

(2-chlorophenyl)[3-hydroxy-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone

Catalog ID
STK191542
SMILES Clc1ccccc1C(=O)N1N=C2C(C1(O)C(F)(F)F)CCCC2

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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 C15H14ClF3N2O2 MW 346.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14ClF3N2O2/c16-11-7-3-1-5-9(11)13(22)21-14(23,15(17,18)19)10-6-2-4-8-12(10)20-21/h1,3,5,7,10,23H,2,4,6,8H2
InChIKey
VFRCJZKXIMFQMA-UHFFFAOYSA-N
Synonyms

(2chlorophenyl)(3hydroxy3(trifluoromethyl)33a4567hexahydro2Hindazol2yl)methanone
(2chlorophenyl)(3hydroxy3(trifluoromethyl)4567tetrahydro3aHindazol2yl)methanone
C1CCC2=NN(C(C2C1)(C(F)(F)F)O)C(=O)C3=CC=CC=C3Cl
InChI=1SC15H14ClF3N2O2c161173159(11)13(22)2114(2315(1718)19)10624812(10)2021h13571023H2468H2
MFCD02911534
ZINC000000196572
ZINC000000196577

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Available files

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