Dioctyl phenyl phosphate

Base Information

• Chemical Name: Dioctyl phenyl phosphate
• CAS No.: 6161-81-5
• Molecular Formula: C22H39 O4 P
• Molecular Weight: 398.523
• European Community (EC) Number: 228-190-2
• DSSTox Substance ID: DTXSID20210629
• Nikkaji Number: J211.429A
• Wikidata: Q83085382
• Mol file: 6161-81-5.mol

Synonyms:Dioctyl phenyl phosphate;6161-81-5;Di-n-octyl phenyl phosphate;di-n-Octylphenylphosphate;EINECS 228-190-2;dioctylphenylphosphoric acid;SCHEMBL2150577;DTXSID20210629;Phosphoric acid dioctylphenyl ester;FT-0625192

Chemical Property of Dioctyl phenyl phosphate

Chemical Property:

• Vapor Pressure: 7.08E-08mmHg at 25°C
• Boiling Point: 450.3°C at 760 mmHg
• Flash Point: 239.5°C
• PSA: 54.57000
• Density: 1.001g/cm³
• LogP: 7.92770
• XLogP3: 8.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 18
• Exact Mass: 398.25859672
• Heavy Atom Count: 27
• Complexity: 347

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Safety Statements: S24/25:Avoid contact with skin and eyes.

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCOP(=O)(OCCCCCCCC)OC1=CC=CC=C1

Technology Process of Dioctyl phenyl phosphate

There total 2 articles about Dioctyl phenyl phosphate 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:

octanol (111-87-5) + O-phenyl phosphorodichloridate (770-12-7) → di-n-octylphenyl phosphate (6161-81-5)

Guidance literature:

With pyridine;

Reference yield:

→ di-n-octylphenyl phosphate (6161-81-5)

Guidance literature:

Octan-1-ol 1. PCl3 2. Erhitzen m. Xylol, wenig H2SO4 3. Cl2 4. Phenol, Toluol, wss. NaOH;

Reference yield:

di-n-octylphenyl phosphate (6161-81-5) → phosphoric acid dioctyl ester (3115-39-7)

Guidance literature:

With methanol; platinum; Hydrogenation;

upstream raw materials:

octanol

O-phenyl phosphorodichloridate

Downstream raw materials:

phosphoric acid dioctyl ester