(5E,9Z,12Z)-5,9,12-Octadecatrienoic Acid
[CAS# 2441-53-4]

Identification

• Name: (5E,9Z,12Z)-5,9,12-Octadecatrienoic Acid
• Synonyms: [2441-53-4]; 5(E),9(Z),12(Z)-OCTADECATRIENOIC ACID
• Molecular Formula: C₁₈H₃₀O₂
• Molecular Weight: 278.43
• CAS Registry Number: 2441-53-4
• SMILES: O=C(O)CCC/C=C/CC\C=C/C\C=C/CCCCC
• InChI: 1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,13-14H,2-5,8,11-12,15-17H2,1H3,(H,19,20)/b7-6-,10-9-,14-13+
• InChIKey: HXQHFNIKBKZGRP-OXXZWVFOSA-N

Properties

• Density: 0.925g/cm³ (Cal.)
• Boiling point: 384.83°C at 760 mmHg (Cal.)
• Flash point: 281.682°C (Cal.)
• Refractive index: 1.491 (Cal.)