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4-Hydroxybutyl methanesulfonate

Base Information Edit
  • Chemical Name:4-Hydroxybutyl methanesulfonate
  • CAS No.:42729-95-3
  • Molecular Formula:C5H12O4S
  • Molecular Weight:168.214
  • Hs Code.:
  • European Community (EC) Number:806-438-6
  • NSC Number:67176
  • DSSTox Substance ID:DTXSID20195407
  • Nikkaji Number:J2.756.749E
  • Wikidata:Q83068322
  • Mol file:42729-95-3.mol
4-Hydroxybutyl methanesulfonate

Synonyms:4-methanesulfonyloxybutanol

Suppliers and Price of 4-Hydroxybutyl methanesulfonate
Supply Marketing:Edit
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
  • Packaging
  • price
Total 41 raw suppliers
Chemical Property of 4-Hydroxybutyl methanesulfonate Edit
Chemical Property:
  • Vapor Pressure:1.12E-05mmHg at 25°C 
  • Refractive Index:1.46 
  • Boiling Point:331.611 °C at 760 mmHg 
  • PKA:14.97±0.10(Predicted) 
  • Flash Point:154.353 °C 
  • PSA:71.98000 
  • Density:1.237 g/cm3 
  • LogP:0.81590 
  • XLogP3:-0.6
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Rotatable Bond Count:5
  • Exact Mass:168.04563003
  • Heavy Atom Count:10
  • Complexity:155
Purity/Quality:

99%, *data from raw suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CS(=O)(=O)OCCCCO
  • Uses 4-Methanesulfonyloxybutanol is a hydrolysis product of busulfan (B689900) which is an Alkylating agent with antileukemic activity.
Technology Process of 4-Hydroxybutyl methanesulfonate

There total 2 articles about 4-Hydroxybutyl methanesulfonate 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:
Guidance literature:
With triethylamine; In dichloromethane; for 1h; Inert atmosphere;
DOI:10.1021/jo9007749
Guidance literature:
With hydrogen; palladium on activated charcoal; In ethanol;
DOI:10.1002/jps.2600620634
Guidance literature:
With sodium hydrogensulfide; In ethanol; at 80 ℃; for 2h;
Refernces Edit
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