Vitas-M small molecule compound

[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](2-methylfuran-3-yl)methanone

Catalog ID
STK046837
SMILES CCC1=NN(C(C1)(O)C(F)(F)F)C(=O)c1ccoc1C

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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 C12H13F3N2O3 MW 290.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13F3N2O3/c1-3-8-6-11(19,12(13,14)15)17(16-8)10(18)9-4-5-20-7(9)2/h4-5,19H,3,6H2,1-2H3
InChIKey
LCKOEVBPKMYNPN-UHFFFAOYSA-N
Synonyms

(3ETHYL5HYDROXY5(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOL1YL)(2METHYLFURAN3YL)METHANONE
(3ETHYL5HYDROXY5(TRIFLUOROMETHYL)4HPYRAZOL1YL)(2METHYLFURAN3YL)METHANONE
CCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=C(OC=C2)C
CCC1=NN(C(C1)(O)C(F)(F)F)C(=O)c1ccoc1C
InChI=1SC12H13F3N2O3c138611(1912(1314)15)17(168)10(18)945207(9)2h4519H36H212H3
MFCD02070689
STK046837
ZINC000000504356
ZINC000000504357

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Available files

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