Methyl 2-cyano-4-fluorobenzoate

• Catalog: OFC127510967-1
• CAS: 127510-96-7
• Category: Fluorinated Nitriles
• Purity: 97%
• MDL Number: MFCD11975805

• Molecular Formula: C9H6FNO2
• Molecular Weight: 179.15
• Molar Refractivity: 42.39

• Bioavailability Score: 0.55
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 1.0
• Veber: 0.0
• Consensus LogP: 1.83
• MLogP: 1.71
• SILICOS-IT: 2.11
• WLogP: 1.9
• XLogP3: 1.59
• iLogP: 1.87
• BBB Permeant: Yes
• CYP1A2 Inhibitor: Yes
• CYP2C19 Inhibitor: No
• CYP2C9 Inhibitor: No
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: No
• GI Absorption: High
• LogKp: -6.26 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.11