4,5-Difluoro-2-methylbenzonitrile

• Catalog: OFC1003708824
• CAS: 1003708-82-4
• Category: Fluorinated Nitriles
• Purity: 98%
• MDL Number: MFCD09996935

• Molecular Formula: C8H5F2N
• Molecular Weight: 153.13
• Molar Refractivity: 36.04

• Bioavailability Score: 0.55
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 2.0
• Veber: 0.0
• Consensus LogP: 2.57
• MLogP: 2.63
• SILICOS-IT: 3.09
• WLogP: 2.99
• XLogP3: 2.21
• iLogP: 1.91
• BBB Permeant: Yes
• CYP1A2 Inhibitor: Yes
• CYP2C19 Inhibitor: No
• CYP2C9 Inhibitor: No
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: No
• GI Absorption: High
• LogKp: -5.66 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.12

• GHS Pictogram: GHS07
• Hazard Statements: H302-H315-H319-H335
• Precautionary Statements: P261-P305+P351+P338