Vitas-M small molecule compound

[5-hydroxy-3,5-bis(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](pyridin-4-yl)methanone

Catalog ID
STK696440
SMILES O=C(N1N=C(CC1(O)C(F)(F)F)C(F)(F)F)c1ccncc1

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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 C11H7F6N3O2 MW 327.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H7F6N3O2/c12-10(13,14)7-5-9(22,11(15,16)17)20(19-7)8(21)6-1-3-18-4-2-6/h1-4,22H,5H2
InChIKey
VWESYDFSCFKICB-UHFFFAOYSA-N
Synonyms

(5hydroxy35bis(trifluoromethyl)45dihydro1Hpyrazol1yl)(pyridin4yl)methanone
(5HYDROXY35BIS(TRIFLUOROMETHYL)4HPYRAZOL1YL)PYRIDIN4YLMETHANONE
35BIS(TRIFLUOROMETHYL)5HYDROXY(2PYRAZOLINYL)4PYRIDYLKETONE
C1C(=NN(C1(C(F)(F)F)O)C(=O)C2=CC=NC=C2)C(F)(F)F
InChI=1SC11H7F6N3O2c1210(1314)759(2211(1516)17)20(197)8(21)61318426h1422H5H2
MFCD00687125
ZINC000000033282
ZINC000000033283

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Available files

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