2-Chloropropyl toluene-4-sulphonate

Base Information

• Chemical Name: 2-Chloropropyl toluene-4-sulphonate
• CAS No.: 54619-29-3
• Molecular Formula: C10H13 Cl O3 S
• Molecular Weight: 248.73
• Hs Code.: 2905590090
• European Community (EC) Number: 259-259-5
• UNII: 2H85W5CLE8
• DSSTox Substance ID: DTXSID00969885
• Nikkaji Number: J266.926I
• Mol file: 54619-29-3.mol

Synonyms:2-chloropropyl 4-methylbenzenesulfonate;54619-29-3;2-Chloropropyl toluene-4-sulphonate;EINECS 259-259-5;2H85W5CLE8;2-Chloro-1-propyl tosylate;UNII-2H85W5CLE8;SCHEMBL8312124;2-chloropropyl-p-toluenesulfonate;DTXSID00969885;Propyl 2-chloro-4-methylbenzenesulfonate;2-Chloropropyl 4-methylbenzene-1-sulfonate;2-Chloro-1-propanol 4-methylbenzenesulfonate;1-Propanol, 2-chloro-, 1-(4-methylbenzenesulfonate)

Chemical Property of 2-Chloropropyl toluene-4-sulphonate

Chemical Property:

• Vapor Pressure: 7.97E-06mmHg at 25°C
• Boiling Point: 386.3°C at 760 mmHg
• Flash Point: 187.4°C
• PSA: 51.75000
• Density: 1.252g/cm³
• LogP: 3.40840
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 248.0273931
• Heavy Atom Count: 15
• Complexity: 276

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC(C)Cl

Technology Process of 2-Chloropropyl toluene-4-sulphonate

There total 1 articles about 2-Chloropropyl toluene-4-sulphonate 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:

2-chloro-1-propanol (78-89-7) + p-toluenesulfonyl chloride (98-59-9) → 2-chloro-1-(toluene-4-sulfonyloxy)-propane (54619-29-3)

Guidance literature:

With pyridine;

Reference yield:

2-chloro-1-(toluene-4-sulfonyloxy)-propane (54619-29-3) → methyl 4-bromo-3-(2-chloro-1-propyloxy)-2-(methylthio)benzoate

Guidance literature:

In N,N-dimethyl-formamide;

upstream raw materials:

2-chloro-1-propanol

p-toluenesulfonyl chloride

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