Organofluorine / Alfa Chemistry
2-Bromo-5-(trifluoromethoxy)aniline

2-Bromo-5-(trifluoromethoxy)aniline

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2-Bromo-5-(trifluoromethoxy)aniline
Catalog OFC887267472
CAS 887267-47-2
Category Fluorinated Aromatic Amines and Anilines
Purity 98%
MDL Number MFCD08458013
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Chemical Data Computational Chemistry
Molecular Formula C7H5BrF3NO
Molecular Weight 191.63
Molar Refractivity 45.23
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 0.0
Veber 0.0
Consensus LogP 2.83
MLogP 2.37
SILICOS-IT 2.38
WLogP 4.2
XLogP3 3.11
iLogP 2.08
BBB Permeant Yes
CYP1A2 Inhibitor Yes
CYP2C19 Inhibitor No
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -5.65 cm/s
P-gp Substrate No
Fraction Csp3 0.14

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