Combretastatin B-3
[CAS# 116518-76-4]

Identification

• Name: Combretastatin B-3
• Synonyms: 4-[2-(3,4,5-Trimethoxyphenyl)Ethyl]Pyrocatechol; Combretastatin B-3; 1,2-Benzenediol, 4-(2-(3,4,5-Trimethoxyphenyl)Ethyl)-
• Molecular Formula: C₁₇H₂₀O₅
• Molecular Weight: 304.34
• CAS Registry Number: 116518-76-4
• SMILES: C1=C(C=C(OC)C(=C1OC)OC)CCC2=CC=C(O)C(=C2)O
• InChI: 1S/C17H20O5/c1-20-15-9-12(10-16(21-2)17(15)22-3)5-4-11-6-7-13(18)14(19)8-11/h6-10,18-19H,4-5H2,1-3H3
• InChIKey: SFWXNQDSPCKFAW-UHFFFAOYSA-N

Properties

• Density: 1.209g/cm³ (Cal.)
• Boiling point: 453.581°C at 760 mmHg (Cal.)
• Flash point: 228.118°C (Cal.)