3-Ketosucrose
[CAS# 1883-12-1]

Identification

• Name: 3-Ketosucrose
• Synonyms: (2R,3S,5R,6R)-2-[(2S,3S,4S,5R)-3,4-Dihydroxy-2,5-Bis(Hydroxymethyl)Tetrahydrofuran-2-Yl]Oxy-3,5-Dihydroxy-6-(Hydroxymethyl)Tetrahydropyran-4-One; (2R,3S,5R,6R)-2-[[(2S,3S,4S,5R)-3,4-Dihydroxy-2,5-Bis(Hydroxymethyl)-2-Tetrahydrofuranyl]Oxy]-3,5-Dihydroxy-6-(Hydroxymethyl)-4-Tetrahydropyranone; (2R,3S,5R,6R)-2-[(2S,3S,4S,5R)-3,4-Dihydroxy-2,5-Dimethylol-Tetrahydrofuran-2-Yl]Oxy-3,5-Dihydroxy-6-Methylol-Tetrahydropyran-4-One
• Molecular Formula: C₁₂H₂₀O₁₁
• Molecular Weight: 340.28
• CAS Registry Number: 1883-12-1
• SMILES: [C@@H]1(C([C@H]([C@H](O[C@@H]1CO)O[C@@]2(O[C@H](CO)[C@H]([C@@H]2O)O)CO)O)=O)O
• InChI: 1S/C12H20O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-7,9-11,13-17,19-20H,1-3H2/t4-,5-,6-,7-,9-,10+,11-,12+/m1/s1
• InChIKey: CUKZGOBWGGOLIQ-QRDRGOPVSA-N

Properties

• Density: 1.774g/cm³ (Cal.)
• Boiling point: 747.021°C at 760 mmHg (Cal.)
• Flash point: 281.575°C (Cal.)