Organofluorine / Alfa Chemistry
4-(Difluoromethoxy)benzoic acid

4-(Difluoromethoxy)benzoic acid

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4-(Difluoromethoxy)benzoic acid
Catalog OFC4837201
CAS 4837-20-1
Category Fluorinated Carboxylic Acid
Purity 98%
MDL Number MFCD00221454
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Chemical Data Computational Chemistry
Molecular Formula C8H6F2O3
Molecular Weight 188.13
Molar Refractivity 40.0
Bioavailability Score 0.56
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 1.0
Veber 0.0
Consensus LogP 2.09
MLogP 1.64
SILICOS-IT 1.64
WLogP 2.83
XLogP3 2.91
iLogP 1.42
BBB Permeant Yes
CYP1A2 Inhibitor No
CYP2C19 Inhibitor No
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -5.38 cm/s
P-gp Substrate No
Fraction Csp3 0.12

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