Organofluorine / Alfa Chemistry
Methyl 3-bromo-4-(difluoromethoxy)benzoate

Methyl 3-bromo-4-(difluoromethoxy)benzoate

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Methyl 3-bromo-4-(difluoromethoxy)benzoate
Catalog OFC200956565
CAS 200956-56-5
Category Fluorinated Esters
Purity 95%
MDL Number MFCD11110884
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Chemical Data Computational Chemistry Health Safety
Molecular Formula C9H7BrF2O3
Molecular Weight 281.05
Molar Refractivity 52.02
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 0.0
Veber 0.0
Consensus LogP 2.99
MLogP 2.64
SILICOS-IT 2.85
WLogP 3.68
XLogP3 3.39
iLogP 2.4
BBB Permeant Yes
CYP1A2 Inhibitor Yes
CYP2C19 Inhibitor Yes
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -5.61 cm/s
P-gp Substrate No
Fraction Csp3 0.22
GHS Pictogram GHS07
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305+P351+P338

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