4-(Trifluoromethyl)phenylacetonitrile

• Catalog: OFC2338752
• CAS: 2338-75-2
• Category: Fluorinated Nitriles
• Purity: 98%
• MDL Number: MFCD00001921

• Molecular Formula: C9H6F3N
• Molecular Weight: 185.15
• Molar Refractivity: 40.97

• Bioavailability Score: 0.55
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 2.0
• Veber: 0.0
• Consensus LogP: 2.77
• MLogP: 2.82
• SILICOS-IT: 3.15
• WLogP: 3.92
• XLogP3: 2.19
• iLogP: 1.78
• BBB Permeant: Yes
• CYP1A2 Inhibitor: Yes
• CYP2C19 Inhibitor: No
• CYP2C9 Inhibitor: No
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: No
• GI Absorption: High
• LogKp: -5.87 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.22