2-[(3R)-7,8-Dimethoxychroman-3-Yl]-6-Hydroxycyclohexa-2,5-Diene-1,4-Dione
[CAS# 158991-20-9]

Identification

• Name: 2-[(3R)-7,8-Dimethoxychroman-3-Yl]-6-Hydroxycyclohexa-2,5-Diene-1,4-Dione
• Synonyms: 2-[(3R)-7,8-Dimethoxychroman-3-Yl]-6-Hydroxy-1,4-Benzoquinone; 2-[(3R)-7,8-Dimethoxy-3-Chromanyl]-6-Hydroxy-1,4-Benzoquinone; 2-[(3R)-7,8-Dimethoxychroman-3-Yl]-6-Hydroxy-P-Benzoquinone
• Molecular Formula: C₁₇H₁₆O₆
• Molecular Weight: 316.31
• CAS Registry Number: 158991-20-9
• SMILES: [C@H]2(C1=CC(C=C(C1=O)O)=O)CC3=C(OC2)C(=C(OC)C=C3)OC
• InChI: 1S/C17H16O6/c1-21-14-4-3-9-5-10(8-23-16(9)17(14)22-2)12-6-11(18)7-13(19)15(12)20/h3-4,6-7,10,19H,5,8H2,1-2H3/t10-/m0/s1
• InChIKey: ZPNCZRGNATWPGL-JTQLQIEISA-N

Properties

• Density: 1.388g/cm³ (Cal.)
• Boiling point: 475.258°C at 760 mmHg (Cal.)
• Flash point: 174.013°C (Cal.)