Tetrabutyl thiopyrophosphate

Base Information

• Chemical Name: Tetrabutyl thiopyrophosphate
• CAS No.: 60052-04-2
• Molecular Formula: C16H36O5P2S2
• Molecular Weight: 434.5316
• DSSTox Substance ID: DTXSID80975489
• Wikidata: Q82960095
• Mol file: 60052-04-2.mol

Synonyms:60052-04-2;o,o,o,o-tetrabutyl dithiodiphosphate;Tetrabutyl S-dithiopyrophosphate;BRN 1716365;Thiopyrophosphoric acid, tetrabutyl ester;Tetrabutyldithiopyrophosphat;DTXSID80975489;4-01-00-01536 (Beilstein Handbook Reference)

Chemical Property of Tetrabutyl thiopyrophosphate

Chemical Property:

• Vapor Pressure: 1.75E-07mmHg at 25°C
• Boiling Point: 438.7°C at 760 mmHg
• Flash Point: 219.1°C
• Density: 1.118g/cm³
• XLogP3: 7.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 18
• Exact Mass: 434.14794059
• Heavy Atom Count: 25
• Complexity: 346

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCOP(=S)(OCCCC)OP(=S)(OCCCC)OCCCC

Technology Process of Tetrabutyl thiopyrophosphate

There total 2 articles about Tetrabutyl thiopyrophosphate 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:

dibutyl chlorothiophosphate (2524-07-4) → 1,2-dithio-diphosphoric acid tetra-O-butyl ester (60052-04-2)

Guidance literature:

With pyridine; water;

DOI:10.1021/ja01154a053

Reference yield:

diphosphorous acid tetrabutyl ester (54305-86-1) → 1,2-dithio-diphosphoric acid tetra-O-butyl ester (60052-04-2)

Guidance literature:

With sulfur; benzene;

upstream raw materials:

diphosphorous acid tetrabutyl ester

dibutyl chlorothiophosphate