4,5,6,7,8,9-Hexahydroxy-2-Oxo-Nonanoic Acid
[CAS# 22594-61-2]

Identification

• Name: 4,5,6,7,8,9-Hexahydroxy-2-Oxo-Nonanoic Acid
• Synonyms: (4S,5R,6R,7R,8R)-4,5,6,7,8,9-Hexahydroxy-2-Oxo-Nonanoic Acid; (4S,5R,6R,7R,8R)-4,5,6,7,8,9-Hexahydroxy-2-Keto-Pelargonic Acid; 2-Kdn
• Molecular Formula: C₉H₁₆O₉
• Molecular Weight: 268.22
• CAS Registry Number: 22594-61-2
• SMILES: [C@@H]([C@@H]([C@H](CC(C(=O)O)=O)O)O)([C@@H]([C@H](O)CO)O)O
• InChI: 1S/C9H16O9/c10-2-5(13)7(15)8(16)6(14)3(11)1-4(12)9(17)18/h3,5-8,10-11,13-16H,1-2H2,(H,17,18)/t3-,5+,6+,7+,8+/m0/s1
• InChIKey: FQHUAUMYHAJTDH-GRCPKETISA-N

Properties

• Density: 1.722g/cm³ (Cal.)
• Boiling point: 679.684°C at 760 mmHg (Cal.)
• Flash point: 378.834°C (Cal.)