(9S,10E)-9-Hydroxy-10-octadecen-12-ynoic acid
[CAS# 7309-58-2]

Identification

• Name: (9S,10E)-9-Hydroxy-10-octadecen-12-ynoic acid
• Molecular Formula: C₁₈H₃₀O₃
• Molecular Weight: 294.43
• CAS Registry Number: 7309-58-2
• SMILES: CCCCCC#C/C=C/[C@H](CCCCCCCC(=O)O)O
• InChI: 1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b14-11+/t17-/m1/s1
• InChIKey: AUBZNAUZNGCKAN-GWKQRERASA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 433.2±40.0°C at 760 mmHg (Cal.)
• Flash point: 229.9±23.8°C (Cal.)