Tagatosazine
[CAS# 13121-64-7]

Identification

• Name: Tagatosazine
• Synonyms: (1R,2R,3R)-1-[5-[(1R,2R,3R)-1,2,3,4-Tetrahydroxybutyl]-2-Pyrazinyl]Butane-1,2,3,4-Tetrol; 1,2,3,4-Butanetetrol, 1,1'-(2,5-Pyrazinediyl)Bis-, (1R-(1R*,1'R*,2R*,2'R*,3S*,3'S*))-; 2,5-Bis-(D-Lyxotetrahydroxybutyl)Pyrazine
• Molecular Formula: C₁₂H₂₀N₂O₈
• Molecular Weight: 320.30
• CAS Registry Number: 13121-64-7
• SMILES: [C@@H](C1=NC=C(N=C1)[C@H]([C@H]([C@@H](CO)O)O)O)([C@H]([C@@H](CO)O)O)O
• InChI: 1S/C12H20N2O8/c15-3-7(17)11(21)9(19)5-1-13-6(2-14-5)10(20)12(22)8(18)4-16/h1-2,7-12,15-22H,3-4H2/t7-,8-,9-,10-,11+,12+/m1/s1
• InChIKey: NPWQIVOYGNUVEB-JKCCIXDMSA-N

Properties

• Density: 1.681g/cm³ (Cal.)
• Boiling point: 764.85°C at 760 mmHg (Cal.)
• Flash point: 416.366°C (Cal.)