Caesalpin J
[CAS# 99217-67-1]

Identification

• Name: Caesalpin J
• Synonyms: Caesalpin J
• Molecular Formula: C₁₇H₁₆O₆
• Molecular Weight: 316.31
• CAS Registry Number: 99217-67-1
• SMILES: C4=C3C12C(=CC(C=C1)=O)OCC(C2OC)(CC3=CC(=C4O)O)O
• InChI: 1S/C17H16O6/c1-22-15-16(21)7-9-4-12(19)13(20)6-11(9)17(15)3-2-10(18)5-14(17)23-8-16/h2-6,15,19-21H,7-8H2,1H3
• InChIKey: GUHDLXNWTKIBDJ-UHFFFAOYSA-N

Properties

• Density: 1.564g/cm³ (Cal.)
• Boiling point: 597.484°C at 760 mmHg (Cal.)
• Flash point: 225.568°C (Cal.)