Vitas-M small molecule compound

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

Catalog ID
STK431635
SMILES CCOc1cccc(c1)C(=O)N1N=C(CC1(O)C(F)F)C(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 C14H14F4N2O3 MW 334.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14F4N2O3/c1-2-23-9-5-3-4-8(6-9)12(21)20-14(22,13(17)18)7-10(19-20)11(15)16/h3-6,11,13,22H,2,7H2,1H3
InChIKey
KAWVZWJWZJFICX-UHFFFAOYSA-N
Synonyms

(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(3ethoxyphenyl)methanone
(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)(3ETHOXYPHENYL)METHANONE
35BIS(DIFLUOROMETHYL)5HYDROXY(2PYRAZOLINYL)3ETHOXYPHENYLKETONE
CCOC1=CC=CC(=C1)C(=O)N2C(CC(=N2)C(F)F)(C(F)F)O
InChI=1SC14H14F4N2O3c122395348(69)12(21)2014(2213(17)18)710(1920)11(15)16h36111322H27H21H3
MFCD03466497
ZINC000006351587
ZINC000006351588

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Available files

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