3,7-Dihydroxy-2-(1,4-Benzodioxan-6-Yl)Chroman-4-One
[CAS# 79986-03-1]

Identification

• Name: 3,7-Dihydroxy-2-(1,4-Benzodioxan-6-Yl)Chroman-4-One
• Synonyms: (2S,3S)-2-(2,3-Dihydro-1,4-Benzodioxin-7-Yl)-3,7-Dihydroxy-Chroman-4-One; (2S,3S)-2-(2,3-Dihydro-1,4-Benzodioxin-7-Yl)-3,7-Dihydroxy-4-Chromanone; 3,7-Dihydroxy-2-(1,4-Benzodioxan-6-Yl)Chroman-4-One
• Molecular Formula: C₁₇H₁₄O₆
• Molecular Weight: 314.29
• CAS Registry Number: 79986-03-1
• SMILES: [C@@H]2([C@@H](C(C1=CC=C(C=C1O2)O)=O)O)C4=CC=C3OCCOC3=C4
• InChI: 1S/C17H14O6/c18-10-2-3-11-13(8-10)23-17(16(20)15(11)19)9-1-4-12-14(7-9)22-6-5-21-12/h1-4,7-8,16-18,20H,5-6H2/t16-,17+/m1/s1
• InChIKey: MGDQKWLRSIIJEI-SJORKVTESA-N

Properties

• Density: 1.48g/cm³ (Cal.)
• Boiling point: 586.107°C at 760 mmHg (Cal.)
• Flash point: 222.15°C (Cal.)