D-Fructose 1-(dihydrogen phosphate) barium salt
[CAS# 34079-63-5]

Identification

• Name: D-Fructose 1-(dihydrogen phosphate) barium salt
• Synonyms: Barium(+2) Cation; (2R,3S,4S)-1,2-Dihydroxy-5-Oxo-6-Phosphonooxy-Hexane-3,4-Diolate; Barium(+2) Cation; (2R,3S,4S)-1,2-Dihydroxy-5-Keto-6-Phosphonooxy-Hexane-3,4-Diolate; Fructose, 1-(Dihydrogen Phosphate), Barium Salt, D-
• Molecular Formula: C₆H₁₁BaO₉P
• Molecular Weight: 395.46
• CAS Registry Number: 34079-63-5
• EINECS: 251-821-8
• SMILES: [C@H]([O-])([C@H]([O-])[C@H](O)CO)C(CO[P](=O)(O)O)=O.[Ba++]
• InChI: 1S/C6H11O9P.Ba/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14;/h3,5-8H,1-2H2,(H2,12,13,14);/q-2;+2/t3-,5-,6-;/m1./s1
• InChIKey: BHSMIXDZOMSSHY-BAOOBMCLSA-N

Properties

• Boiling point: 692.5°C at 760 mmHg (Cal.)
• Flash point: 372.6°C (Cal.)