(2R,3S)-2-(3,4,5-Trihydroxyphenyl)Chroman-3,5,7-Triol
[CAS# 1617-55-6]

Identification

• Name: (2R,3S)-2-(3,4,5-Trihydroxyphenyl)Chroman-3,5,7-Triol
• Synonyms: Gallocatechol; Gallocatechol, (+-)-; Dl-Gallocatechin
• Molecular Formula: C₁₅H₁₄O₇
• Molecular Weight: 306.27
• CAS Registry Number: 1617-55-6
• SMILES: [C@@H]1(OC2=C(C[C@@H]1O)C(=CC(=C2)O)O)C3=CC(=C(C(=C3)O)O)O
• InChI: 1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15+/m0/s1
• InChIKey: XMOCLSLCDHWDHP-SWLSCSKDSA-N

Properties

• Density: 1.696g/cm³ (Cal.)
• Boiling point: 685.63°C at 760 mmHg (Cal.)
• Flash point: 368.456°C (Cal.)