Organofluorine / Alfa Chemistry
2-Bromo-1-(5-fluoro-2-methoxyphenyl)ethanone

2-Bromo-1-(5-fluoro-2-methoxyphenyl)ethanone

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2-Bromo-1-(5-fluoro-2-methoxyphenyl)ethanone
Catalog OFC343044-2
CAS 343-04-4
Category Fluorinated Ketones
Purity 98%
MDL Number MFCD03425169
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Chemical Data Computational Chemistry
Molecular Formula C9H8BrFO2
Molecular Weight 247.06
Molar Refractivity 50.96
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 0.0
Veber 0.0
Consensus LogP 2.53
MLogP 2.3
SILICOS-IT 3.14
WLogP 2.83
XLogP3 2.47
iLogP 1.91
BBB Permeant Yes
CYP1A2 Inhibitor Yes
CYP2C19 Inhibitor No
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -6.05 cm/s
P-gp Substrate No
Fraction Csp3 0.22

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