Neobaicalein
[CAS# 55084-08-7]

Identification

• Name: Neobaicalein
• Synonyms: 5-Hydroxy-2-(2-Hydroxy-6-Methoxy-Phenyl)-6,7,8-Trimethoxy-Chromen-4-One; 5-Hydroxy-2-(2-Hydroxy-6-Methoxyphenyl)-6,7,8-Trimethoxy-4-Chromenone; 5-Hydroxy-2-(2-Hydroxy-6-Methoxy-Phenyl)-6,7,8-Trimethoxy-Chromone
• Molecular Formula: C₁₉H₁₈O₈
• Molecular Weight: 374.35
• CAS Registry Number: 55084-08-7
• SMILES: C3=CC(=C(C2=CC(C1=C(C(=C(OC)C(=C1O2)OC)OC)O)=O)C(=C3)OC)O
• InChI: 1S/C19H18O8/c1-23-11-7-5-6-9(20)13(11)12-8-10(21)14-15(22)17(24-2)19(26-4)18(25-3)16(14)27-12/h5-8,20,22H,1-4H3
• InChIKey: GMQFOKBGMKVUQZ-UHFFFAOYSA-N

Properties

• Density: 1.376g/cm³ (Cal.)
• Boiling point: 636.916°C at 760 mmHg (Cal.)
• Flash point: 230.888°C (Cal.)