Octyl isooctadecanoate

Base Information

• Chemical Name: Octyl isooctadecanoate
• CAS No.: 93803-86-2
• Molecular Formula: C5H4N2O4
• Molecular Weight: 396.68988
• European Community (EC) Number: 298-360-9
• DSSTox Substance ID: DTXSID60917867
• Wikidata: Q82889646
• Mol file: 93803-86-2.mol

Synonyms:Octyl isooctadecanoate;93803-86-2;EINECS 298-360-9;Octyl 16-methylheptadecanoate;DTXSID60917867

Chemical Property of Octyl isooctadecanoate

Chemical Property:

• Boiling Point: 412.2 °C at 760 mmHg
• Flash Point: 203.1 °C
• PSA: 26.30000
• Density: 1.64g/cm³
• LogP: 9.00750
• XLogP3: 11.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 23
• Exact Mass: 396.396730897
• Heavy Atom Count: 28
• Complexity: 312

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCOC(=O)CCCCCCCCCCCCCCC(C)C