Organofluorine / Alfa Chemistry
1-(2,5-Dichlorophenyl)-2,2,2-trifluoroethanone

1-(2,5-Dichlorophenyl)-2,2,2-trifluoroethanone

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1-(2,5-Dichlorophenyl)-2,2,2-trifluoroethanone
Catalog OFC886371228
CAS 886371-22-8
Category Fluorinated Ketones
Purity 95%
MDL Number MFCD02260845
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Chemical Data Computational Chemistry
Molecular Formula C8H3Cl2F3O
Molecular Weight 243.01
Molar Refractivity 46.85
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 1.0
Veber 0.0
Consensus LogP 3.67
MLogP 3.37
SILICOS-IT 4.03
WLogP 5.0
XLogP3 3.98
iLogP 1.95
BBB Permeant Yes
CYP1A2 Inhibitor Yes
CYP2C19 Inhibitor No
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -4.96 cm/s
P-gp Substrate No
Fraction Csp3 0.12

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