2-Methylisocitric acid
[CAS# 6061-95-6]

Identification

• Name: 2-Methylisocitric acid
• Synonyms: (2R,3S)2-Methylisocitrate; Cpd-618; 1,2,3-Butanetricarboxylic Acid, 3-Hydroxy-
• Molecular Formula: C₇H₁₀O₇
• Molecular Weight: 206.15
• CAS Registry Number: 6061-95-6
• SMILES: C(C(C(O)(C)C(O)=O)C(O)=O)C(O)=O
• InChI: 1S/C7H10O7/c1-7(14,6(12)13)3(5(10)11)2-4(8)9/h3,14H,2H2,1H3,(H,8,9)(H,10,11)(H,12,13)
• InChIKey: HHKPKXCSHMJWCF-UHFFFAOYSA-N

Properties

• Desity: 1.638g/cm³ (Cal.)
• Boiling point: 330.982°C at 760 mmHg (Cal.)
• Flash point: 168.18°C (Cal.)