Pseudourea, 2-hexadecyl-2-thio-, hydrochloride

Base Information

• Chemical Name: Pseudourea, 2-hexadecyl-2-thio-, hydrochloride
• CAS No.: 42024-27-1
• Molecular Formula: C17H37ClN2S
• Molecular Weight: 337.013
• DSSTox Substance ID: DTXSID60194853
• Mol file: 42024-27-1.mol

Synonyms:2-Hexadecyl-2-thiopseudourea hydrochloride;Pseudourea, 2-hexadecyl-2-thio-, hydrochloride;AI3-19869;42024-27-1;Carbamimidothioc acid, hexadecyl ester, monohydrochloride;C17H36N2S.ClH;DTXSID60194853;C17-H36-N2-S.Cl-H;LS-126161;Carbamimidothioic acid, hexadecyl ester, monohydrochloride;Carbamimidothioic acid, hexadecyl ester, hydrochloride (1:1)

Chemical Property of Pseudourea, 2-hexadecyl-2-thio-, hydrochloride

Chemical Property:

• Vapor Pressure: 1.08E-06mmHg at 25°C
• Boiling Point: 402.6°Cat760mmHg
• Flash Point: 197.3°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 16
• Exact Mass: 336.2365981
• Heavy Atom Count: 21
• Complexity: 207

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCSC(=N)N.Cl

Technology Process of Pseudourea, 2-hexadecyl-2-thio-, hydrochloride

There total 1 articles about Pseudourea, 2-hexadecyl-2-thio-, hydrochloride 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:

1-Chlorohexadecan (4860-03-1) + thiourea (17356-08-0) → S-hexadecyl-isothiourea; hydrochloride (42024-27-1)

Guidance literature:

With ethanol;

Reference yield:

S-hexadecyl-isothiourea; hydrochloride (42024-27-1) → 1-hexadecanesulfonyl chloride (38775-38-1)

Guidance literature:

With methanol; chlorine;

DOI:10.1021/ja01289a016

upstream raw materials:

1-Chlorohexadecan

thiourea

Downstream raw materials:

1-hexadecanesulfonyl chloride