Organofluorine / Alfa Chemistry
Methyl 2-(4-bromo-2-fluorophenyl)acetate

Methyl 2-(4-bromo-2-fluorophenyl)acetate

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Methyl 2-(4-bromo-2-fluorophenyl)acetate
Catalog OFC193290196-2
CAS 193290-19-6
Category Fluorinated Esters
Purity 98%
MDL Number MFCD20483545
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Chemical Data Computational Chemistry
Molecular Formula C9H8BrFO2
Molecular Weight 247.06
Molar Refractivity 49.96
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 0.0
Veber 0.0
Consensus LogP 2.81
MLogP 3.11
SILICOS-IT 3.14
WLogP 2.72
XLogP3 2.5
iLogP 2.55
BBB Permeant Yes
CYP1A2 Inhibitor Yes
CYP2C19 Inhibitor No
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -6.03 cm/s
P-gp Substrate No
Fraction Csp3 0.22

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