Methyl 4-bromo-3-(trifluoromethyl)benzoate

• Catalog: OFC107317588
• CAS: 107317-58-8
• Category: Fluorinated Esters
• Purity: 98%
• MDL Number: MFCD10566409

• Molecular Formula: C9H6BrF3O2
• Molecular Weight: 283.04
• Molar Refractivity: 50.42

• Bioavailability Score: 0.55
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 0.0
• Veber: 0.0
• Consensus LogP: 3.47
• MLogP: 3.66
• SILICOS-IT: 3.44
• WLogP: 4.41
• XLogP3: 3.35
• iLogP: 2.47
• BBB Permeant: Yes
• CYP1A2 Inhibitor: Yes
• CYP2C19 Inhibitor: No
• CYP2C9 Inhibitor: No
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: No
• GI Absorption: High
• LogKp: -5.65 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.22

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