Calcium Sucrose Phosphate
[CAS# 12676-30-1]

Identification

• Name: Calcium Sucrose Phosphate
• Synonyms: Hydrogen Phosphate; Calcium; (2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-Dihydroxy-2,5-Bis(Hydroxymethyl)Tetrahydrofuran-2-Yl]Oxy-6-(Hydroxymethyl)Tetrahydropyran-3,4,5-Triol; Hydrogen Phosphate; Calcium; (2R,3R,4S,5S,6R)-2-[[(2S,3S,4S,5R)-3,4-Dihydroxy-2,5-Bis(Hydroxymethyl)-2-Tetrahydrofuranyl]Oxy]-6-(Hydroxymethyl)Tetrahydropyran-3,4,5-Triol
• Molecular Formula: C₁₂H₂₃CaO₁₅P
• Molecular Weight: 478.36
• CAS Registry Number: 12676-30-1
• SMILES: [C@@]1(O[C@@H]([C@@H](O)[C@@H]1O)CO)(O[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)CO)CO.O=[P]([O-])([O-])O.[Ca++]
• InChI: 1S/C12H22O11.Ca.H3O4P/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;;1-5(2,3)4/h4-11,13-20H,1-3H2;;(H3,1,2,3,4)/q;+2;/p-2/t4-,5-,6-,7-,8+,9-,10+,11-,12+;;/m1../s1
• InChIKey: KBFVUAOIGKSBPT-HCJAYUHRSA-L

Properties

• Boiling point: 697.1°C at 760 mmHg (Cal.)
• Flash point: 375.4°C (Cal.)