2-Keto-3-Deoxy-1,7-Dicarboxyheptonic Acid
[CAS# 99778-26-4]

Identification

• Name: 2-Keto-3-Deoxy-1,7-Dicarboxyheptonic Acid
• Synonyms: 2,3,4-Trihydroxy-6-Oxo-Heptanedioic Acid; 2,3,4-Trihydroxy-6-Keto-Pimelic Acid; 2-Kddha
• Molecular Formula: C₇H₁₀O₈
• Molecular Weight: 222.15
• CAS Registry Number: 99778-26-4
• SMILES: C(C(C(O)=O)=O)C(C(C(C(O)=O)O)O)O
• InChI: 1S/C7H10O8/c8-2(1-3(9)6(12)13)4(10)5(11)7(14)15/h2,4-5,8,10-11H,1H2,(H,12,13)(H,14,15)
• InChIKey: IEBQXKOEWCQOHR-UHFFFAOYSA-N

Properties

• Density: 1.79g/cm³ (Cal.)
• Boiling point: 633.842°C at 760 mmHg (Cal.)
• Flash point: 351.141°C (Cal.)