Vitas-M small molecule compound

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

Catalog ID
STK430821
SMILES Clc1cccc(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 C12H9ClF4N2O2 MW 324.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9ClF4N2O2/c13-7-3-1-2-6(4-7)10(20)19-12(21,11(16)17)5-8(18-19)9(14)15/h1-4,9,11,21H,5H2
InChIKey
PEOGIYMLYULQPC-UHFFFAOYSA-N
Synonyms

(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(3chlorophenyl)methanone
(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)(3CHLOROPHENYL)METHANONE
35BIS(DIFLUOROMETHYL)5HYDROXY(2PYRAZOLINYL)3CHLOROPHENYLKETONE
C1C(=NN(C1(C(F)F)O)C(=O)C2=CC(=CC=C2)Cl)C(F)F
InChI=1SC12H9ClF4N2O2c1373126(47)10(20)1912(2111(16)17)58(1819)9(14)15h1491121H5H2
MFCD03465820
ZINC000000204460
ZINC000000204465

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Available files

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