1-Chloro-3-nitro-5-(trifluoromethyl)benzene

• Catalog: OFC401934-2
• CAS: 401-93-4
• Category: Aromatic Fluorocarbons
• Purity: 97%
• MDL Number: MFCD03412202

• Molecular Formula: C7H3ClF3NO2
• Molecular Weight: 225.55
• Molar Refractivity: 45.28

• Bioavailability Score: 0.55
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 0.0
• Veber: 0.0
• Consensus LogP: 2.63
• MLogP: 2.53
• SILICOS-IT: 1.39
• WLogP: 4.42
• XLogP3: 3.26
• iLogP: 1.54
• BBB Permeant: Yes
• CYP1A2 Inhibitor: Yes
• CYP2C19 Inhibitor: No
• CYP2C9 Inhibitor: No
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: No
• GI Absorption: High
• LogKp: -5.36 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.14

• GHS Pictogram: GHS07
• Hazard Statements: H302-H315-H320-H335
• Precautionary Statements: P264-P270-P301+P312-P330