3-Chloro-4-(trifluoromethoxy)benzoic acid

• Catalog: OFC158580939
• CAS: 158580-93-9
• Category: Fluorinated Carboxylic Acid
• Purity: 97%
• MDL Number: MFCD01631556

• Molecular Formula: C8H4ClF3O3
• Molecular Weight: 240.56
• Molar Refractivity: 45.09

• Bioavailability Score: 0.56
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 0.0
• Veber: 0.0
• Consensus LogP: 2.97
• MLogP: 2.36
• SILICOS-IT: 2.48
• WLogP: 4.2
• XLogP3: 4.01
• iLogP: 1.79
• BBB Permeant: Yes
• CYP1A2 Inhibitor: Yes
• CYP2C19 Inhibitor: No
• CYP2C9 Inhibitor: No
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: No
• GI Absorption: High
• LogKp: -4.92 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.12