949-13-3

Basic information

• Product Name: o-octylphenol
• Synonyms: o-octylphenol;2-OCTYLPHENOL
• CAS NO: 949-13-3
• Molecular Formula: C₁₄H₂₂O
• Molecular Weight: 206.32388
• EINECS: 213-437-9
• Mol File: 949-13-3.mol
• Article Data: 8

Chemical Properties

• Melting Point: 18-18.5 °C
• Boiling Point: 305.19°C (rough estimate)
• Flash Point: 165.5°C
• Appearance: /
• Density: 0.9282 (rough estimate)
• Refractive Index: 1.6324 (estimate)
• PKA: 10.43±0.30(Predicted)
• Water Solubility: 2.857mg/L(25 oC)
• CAS DataBase Reference: o-octylphenol(CAS DataBase Reference)
• NIST Chemistry Reference: o-octylphenol(949-13-3)
• EPA Substance Registry System: o-octylphenol(949-13-3)

Safety Data

• Hazardous Substances Data: 949-13-3(Hazardous Substances Data)

Usage

InChI:InChI=1/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

Upstream product

• 5272-02-6 1-ethyl-1-methylpentyl chloride 
• 108-95-2 phenol 
• 123-04-6 3-(chloromethyl)heptane 
• 104-76-7 2-Ethylhexyl alcohol 
• 1632-16-2 2-ethyl-1-hexene 
• 111-66-0 oct-1-ene 
• 824-91-9 O-methoxymethylphenol 
• 217187-77-4 1-<2-(methoxymethyleneoxy)phenyl>octane 
• 124-13-0 Octanal 
• 2589-73-3 1-(4-hydroxyphenyl)octanone 

Downstream Products

• 4467-92-9 2-Octyl-4,6-dinitrophenol 
• 93156-88-8 (2-octyl-phenoxy)-acetic acid 
• 15417-04-6 2-Hydroxy-3-octyl-benzoesaeure, '3-Octyl-salicylsaeure' 

Relevant articles and documents

Mesoporous aromatic frameworks modified by metal chlorides in phenol alkylation with oct-1-ene

Mesoporous polyaromatic frameworks (PAF) based on tetraphenylmethane were synthesized. The PAF/AlCl3 and PAF/FeCl3 catalysts were prepared by impregnating the synthesized products with aluminum and iron chlorides, respectively. The r

Metal cation-exchanged montmorillonite (Mn+-mont)-catalysed aromatic alkylation with aldehydes and ketones

The alkylation of aromatic compounds with aldehydes and ketones in the presence of a variety of metal cation-exchanged montmorillonites (Mn+-mont; Mn+ = Zr4+, Al3+, Fe3+, Zn2+, H+, Na+) has been investigated. Al3+- and Zr4+-Monts are revealed to be effective as catalysts, while no reaction takes place with Na+-mont. Al3+-Mont-catalysed alkylation of phenol with several aldehydes produces mainly or almost solely the corresponding gem-bis(hydroxyphenyl)alkanes (bisphenols) in good yields, while that with several ketones affords selectively the corresponding alkylphenols in moderate to good yields. The alkylation always occurs at the carbonyl carbon without any skeletal rearrangement and the kind of products depends much on the steric hindrance of an electrophilic intermediary carbocation. The alkylation of anisole, veratrole and p-cresol proceeds well, while that of toluene, benzene, chlorobenzene and nitrobenzene scarcely occurs.

Catalysts for alkoxylation reactions

Catalysts producing a sharply peaked alkoxylation distribution during the alkoxylation of organic materials comprise mixtures of BF3 and metal alkyls or metal alkoxides, SiF4 and metal alkyls or metal alkoxides, or mixtures of these catalysts.