5-(Trifluoromethyl)nicotinonitrile

• Catalog: OFC951624832
• CAS: 951624-83-2
• Category: Fluorinated Nitriles
• Purity: 95%
• MDL Number: MFCD07368841

• Molecular Formula: C7H3F3N2
• Molecular Weight: 172.11
• Molar Refractivity: 33.95

• Bioavailability Score: 0.55
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 1.0
• Veber: 0.0
• Consensus LogP: 1.82
• MLogP: 0.89
• SILICOS-IT: 2.32
• WLogP: 3.12
• XLogP3: 1.45
• iLogP: 1.32
• BBB Permeant: Yes
• CYP1A2 Inhibitor: Yes
• CYP2C19 Inhibitor: No
• CYP2C9 Inhibitor: No
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: No
• GI Absorption: High
• LogKp: -6.32 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.14

• GHS Pictogram: GHS05; GHS06
• Hazard Statements: H301-H315-H318-H335
• Packing Group: Ⅲ
• Precautionary Statements: P261-P280-P301+P310-P305+P351+P338