(3R,4S,5R,6R)-6-(Hydroxymethyl)-3-[3-(3'-Methoxyspiro[Adamantane-2,4'-Dioxetane]-3'-Yl)Phenyl]Oxane-2,3,4,5-Tetrol
[CAS# 123954-01-8]

Identification

• Name: (3R,4S,5R,6R)-6-(Hydroxymethyl)-3-[3-(3'-Methoxyspiro[Adamantane-2,4'-Dioxetane]-3'-Yl)Phenyl]Oxane-2,3,4,5-Tetrol
• Synonyms: (3R,4S,5R,6R)-6-(Hydroxymethyl)-3-[3-(3'-Methoxyspiro[Adamantane-2,4'-Dioxetane]-3'-Yl)Phenyl]Tetrahydropyran-2,3,4,5-Tetrol; (3R,4S,5R,6R)-6-(Hydroxymethyl)-3-[3-(3'-Methoxy-3'-Spiro[Adamantane-2,4'-Dioxetane]Yl)Phenyl]Tetrahydropyran-2,3,4,5-Tetrol; (3R,4S,5R,6R)-3-[3-(3'-Methoxyspiro[Adamantane-2,4'-Dioxetane]-3'-Yl)Phenyl]-6-Methylol-Tetrahydropyran-2,3,4,5-Tetrol
• Molecular Formula: C₂₄H₃₂O₉
• Molecular Weight: 464.51
• CAS Registry Number: 123954-01-8
• SMILES: [C@]1(C(O)O[C@@H]([C@@H]([C@@H]1O)O)CO)(O)C2=CC=CC(=C2)C3(OOC34C6CC5CC(CC4C5)C6)OC
• InChI: 1S/C24H32O9/c1-30-24(23(32-33-24)16-6-12-5-13(8-16)9-17(23)7-12)15-4-2-3-14(10-15)22(29)20(27)19(26)18(11-25)31-21(22)28/h2-4,10,12-13,16-21,25-29H,5-9,11H2,1H3/t12?,13?,16?,17?,18-,19+,20+,21?,22-,23?,24?/m1/s1
• InChIKey: ZIOCTOWDUYBVCA-ZOWZHXDVSA-N

Properties

• Density: 1.515g/cm³ (Cal.)
• Boiling point: 635.568°C at 760 mmHg (Cal.)
• Flash point: 338.18°C (Cal.)