o-Octylphenol
[CAS# 949-13-3]

Identification

• Name: o-Octylphenol
• Synonyms: Phenol, 2-Octyl-; 4-06-00-03472 (Beilstein Handbook Reference)
• Molecular Formula: C₁₄H₂₂O
• Molecular Weight: 206.33
• CAS Registry Number: 949-13-3
• EINECS: 266-717-8
• SMILES: C1=CC(=C(C=C1)CCCCCCCC)O
• InChI: 1S/C14H22O/c1-2-3-4-5-6-7-10-13-11-8-9-12-14(13)15/h8-9,11-12,15H,2-7,10H2,1H3
• InChIKey: DUIOKRXOKLLURE-UHFFFAOYSA-N

Properties

• Density: 0.939g/cm³ (Cal.)
• Boiling point: 304.808°C at 760 mmHg (Cal.)
• Flash point: 165.522°C (Cal.)

References

• (1): Jorge Eduardo Loyo-Rosales, Clifford Paul Rice and Alba Torrents. Fate and distribution of the octyl- and nonylphenol ethoxylates and some carboxylated transformation products in the Back River, Maryland, J. Environ. Monit., 2010, 12, 614.