Isooctyl (9Z,12Z)-Octadeca-9,12-Dienoate
[CAS# 67874-38-8]

Identification

• Name: Isooctyl (9Z,12Z)-Octadeca-9,12-Dienoate
• Synonyms: (9Z,12Z)-Octadeca-9,12-Dienoic Acid 6-Methylheptyl Ester; 9,12-Octadecadienoic Acid (9Z,12Z)-, Isooctyl Ester
• Molecular Formula: C₂₆H₄₈O₂
• Molecular Weight: 392.66
• CAS Registry Number: 67874-38-8
• EINECS: 267-467-2
• SMILES: C(C(OCCCCCC(C)C)=O)CCCCCC\C=C/C/C=C\CCCCC
• InChI: 1S/C26H48O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-26(27)28-24-21-18-19-22-25(2)3/h8-9,11-12,25H,4-7,10,13-24H2,1-3H3/b9-8-,12-11-
• InChIKey: SHJGZTHMRQYWME-MURFETPASA-N

Properties

• Density: 0.875g/cm³ (Cal.)
• Boiling point: 467.758°C at 760 mmHg (Cal.)
• Flash point: 84.355°C (Cal.)