N-Desmethyl Sorafenib
[CAS# 284461-74-1]

Identification

• Name: N-Desmethyl Sorafenib
• Synonyms: C1=CC(=CC=C1NC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)OC3=CC(=NC=C3)C(=O)N
• Molecular Formula: C₂₀H₁₄ClF₃N₄O₃
• Molecular Weight: 450.80
• CAS Registry Number: 284461-74-1
• SMILES: C1=CC(=CC=C1NC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)OC3=CC(=NC=C3)C(=O)N

Properties

• Solubility: 0.1102 mg/L (25 ºC water)
• Density: 1.5±0.1 g/cm³, Calc.^*
• Index of Refraction: 1.648, Calc.^*
• Melting point: 265.70 ºC
• Boiling Point: 613.69 ºC, 507.0±50.0 ºC (760 mmHg), Calc.^*
• Flash Point: 260.4±30.1 ºC, Calc.^*

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software.

Safety Data

• Hazard Symbols: GHS07 Warning
• Hazard Statements: H302-H315-H319-H335
• Precautionary Statements: P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501