Acetic acid, (4-octylphenoxy)-

Base Information

• Chemical Name: Acetic acid, (4-octylphenoxy)-
• CAS No.: 15234-85-2
• Molecular Formula: C16H24 O3
• Molecular Weight: 264.36
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID60165003
• Nikkaji Number: J592.105H
• Wikidata: Q83034118
• Mol file: 15234-85-2.mol

Synonyms:Acetic acid, (4-octylphenoxy)-;15234-85-2;2-(4-octylphenoxy)acetic acid;4-OCTYLPHENOXY-ACETIC ACID;4-Octylphenoxy acetic acid;p-octyl-phenoxy-acetic acid;SCHEMBL5696314;4-OCTYLPHENOXYACETIC ACID;DTXSID60165003;AKOS003608626

Chemical Property of Acetic acid, (4-octylphenoxy)-

Chemical Property:

• Vapor Pressure: 6.92E-07mmHg at 25°C
• Melting Point: 92-93 °C
• Boiling Point: 393.2°Cat760mmHg
• PKA: 3.22±0.10(Predicted)
• Flash Point: 137.4°C
• PSA: 46.53000
• Density: 1.03g/cm³
• LogP: 4.05300
• Storage Temp.: 0-6°C
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 10
• Exact Mass: 264.17254462
• Heavy Atom Count: 19
• Complexity: 232

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC1=CC=C(C=C1)OCC(=O)O

Technology Process of Acetic acid, (4-octylphenoxy)-

There total 3 articles about Acetic acid, (4-octylphenoxy)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

p-Octylphenol (1806-26-4) + bromoacetic acid (79-08-3) → 4-octylphenoxyacetic acid (15234-85-2)

Guidance literature:

With potassium hydroxide;

DOI:10.1021/jm00314a006

Reference yield:

p-Octylphenol (1806-26-4) + chloroacetic acid ethyl ester (105-39-5) → 4-octylphenoxyacetic acid (15234-85-2)

Guidance literature:

Reference yield:

→ 4-octylphenoxyacetic acid (15234-85-2)

Guidance literature:

Entspr. Phenol, ClCH2-CO2Et, NaOH;

upstream raw materials:

p-Octylphenol

chloroacetic acid ethyl ester

bromoacetic acid