1,2,4-Benzenetricarboxylic Acid, Isooctyl Ester
[CAS# 68186-32-3]

Identification

• Name: 1,2,4-Benzenetricarboxylic Acid, Isooctyl Ester
• Synonyms: 6-Methylheptan-1-Ol; Trimellitic Acid; Trimellitic Anhydride, Isooctyl Alcohol Ester; 1,2,4-Benzenetricarboxylic Acid, Isooctyl Ester
• Molecular Formula: C₁₇H₂₄O₇
• Molecular Weight: 340.37
• CAS Registry Number: 68186-32-3
• EINECS: 269-038-5
• SMILES: C1=C(C=CC(=C1C(=O)O)C(=O)O)C(=O)O.C(C(C)C)CCCCO
• InChI: 1S/C9H6O6.C8H18O/c10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15;1-8(2)6-4-3-5-7-9/h1-3H,(H,10,11)(H,12,13)(H,14,15);8-9H,3-7H2,1-2H3
• InChIKey: DAQNBKRYDLKJMJ-UHFFFAOYSA-N

Properties

• Boiling point: 505.5°C at 760 mmHg (Cal.)
• Flash point: 273.6°C (Cal.)