Organofluorine / Alfa Chemistry
2-Bromo-5-(trifluoromethyl)benzyl Alcohol

2-Bromo-5-(trifluoromethyl)benzyl Alcohol

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2-Bromo-5-(trifluoromethyl)benzyl Alcohol
Catalog OFC869725531
CAS 869725-53-1
Category Fluorinated Aromatic Alcohols and Phenols
Purity 95%
MDL Number MFCD04973761
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Chemical Data Computational Chemistry
Molecular Formula C8H6BrF3O
Molecular Weight 255.03
Molar Refractivity 45.27
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 1.0
Veber 0.0
Consensus LogP 3.11
MLogP 3.32
SILICOS-IT 3.38
WLogP 3.96
XLogP3 2.61
iLogP 2.28
BBB Permeant Yes
CYP1A2 Inhibitor Yes
CYP2C19 Inhibitor No
CYP2C9 Inhibitor No
CYP2D6 Inhibitor Yes
CYP3A4 Inhibitor No
GI Absorption High
LogKp -6.0 cm/s
P-gp Substrate No
Fraction Csp3 0.25

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