(2R,3R,4R)-2-(3,4-Dihydroxyphenyl)Chroman-3,4,7,8-Tetrol
[CAS# 38081-16-2]

Identification

• Name: (2R,3R,4R)-2-(3,4-Dihydroxyphenyl)Chroman-3,4,7,8-Tetrol
• Synonyms: 3,3',4,4',7,8-Hexahydroxyflavan; Melacacidin; 2H-1-Benzopyran-3,4,7,8-Tetrol, 2-(3,4-Dihydroxyphenyl)-3,4-Dihydro-, (2R-(2Alpha,3Alpha,4Alpha))-
• Molecular Formula: C₁₅H₁₄O₇
• Molecular Weight: 306.27
• CAS Registry Number: 38081-16-2
• SMILES: [C@@H]1(OC2=C([C@@H](O)[C@H]1O)C=CC(=C2O)O)C3=CC(=C(C=C3)O)O
• InChI: 1S/C15H14O7/c16-8-3-1-6(5-10(8)18)14-13(21)11(19)7-2-4-9(17)12(20)15(7)22-14/h1-5,11,13-14,16-21H/t11-,13-,14-/m1/s1
• InChIKey: JEUXGAUBSWADEA-MRVWCRGKSA-N

Properties

• Density: 1.709g/cm³ (Cal.)
• Boiling point: 607.062°C at 760 mmHg (Cal.)
• Flash point: 320.94°C (Cal.)