3-Hydroxynonyl Isobutyrate
[CAS# 68227-52-1]

Identification

• Name: 3-Hydroxynonyl Isobutyrate
• Synonyms: 2-Methylpropanoic Acid 3-Hydroxynonyl Ester; 2-Methylpropionic Acid 3-Hydroxynonyl Ester
• Molecular Formula: C₁₃H₂₆O₃
• Molecular Weight: 230.35
• CAS Registry Number: 68227-52-1
• EINECS: 269-364-8
• SMILES: C(OC(=O)C(C)C)CC(O)CCCCCC
• InChI: 1S/C13H26O3/c1-4-5-6-7-8-12(14)9-10-16-13(15)11(2)3/h11-12,14H,4-10H2,1-3H3
• InChIKey: BKLLEFBQDROZNE-UHFFFAOYSA-N

Properties

• Density: 0.941g/cm³ (Cal.)
• Boiling point: 281.622°C at 760 mmHg (Cal.)
• Flash point: 100.812°C (Cal.)