2-Ethylhexyl Hydrogen 2-Butenedioate
[CAS# 45173-95-3]

Identification

• Name: 2-Ethylhexyl Hydrogen 2-Butenedioate
• Synonyms: (E)-4-(2-Ethylhexoxy)-4-Oxo-But-2-Enoic Acid; (E)-4-(2-Ethylhexoxy)-4-Keto-But-2-Enoic Acid; 2-Ethylhexyl Hydrogen 2-Butenedioate
• Molecular Formula: C₁₂H₂₀O₄
• Molecular Weight: 228.29
• CAS Registry Number: 45173-95-3
• EINECS: 256-201-0
• SMILES: C(C(CCCC)CC)OC(\C=C\C(O)=O)=O
• InChI: 1S/C12H20O4/c1-3-5-6-10(4-2)9-16-12(15)8-7-11(13)14/h7-8,10H,3-6,9H2,1-2H3,(H,13,14)/b8-7+
• InChIKey: IQBLWPLYPNOTJC-BQYQJAHWSA-N

Properties

• Density: 1.043g/cm³ (Cal.)
• Boiling point: 342°C at 760 mmHg (Cal.)
• Flash point: 122.9°C (Cal.)