5-Bromo-2-(trifluoromethoxy)benzonitrile

• Catalog: OFC1210906152
• CAS: 1210906-15-2
• Category: Fluorinated Nitriles
• Purity: 97%
• MDL Number: MFCD13185875

• Molecular Formula: C8H3BrF3NO
• Molecular Weight: 266.02
• Molar Refractivity: 45.54

• Bioavailability Score: 0.55
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 0.0
• Veber: 0.0
• Consensus LogP: 3.12
• MLogP: 2.3
• SILICOS-IT: 3.07
• WLogP: 4.48
• XLogP3: 3.51
• iLogP: 2.24
• BBB Permeant: Yes
• CYP1A2 Inhibitor: Yes
• CYP2C19 Inhibitor: Yes
• CYP2C9 Inhibitor: No
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: No
• GI Absorption: High
• LogKp: -5.43 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.12