Thiosulfuric acid, S-(2-((1-propylhexyl)amino)ethyl) ester

Base Information

• Chemical Name: Thiosulfuric acid, S-(2-((1-propylhexyl)amino)ethyl) ester
• CAS No.: 924-08-3
• Molecular Formula: C₁₁H₂₅NO₃S₂
• Molecular Weight: 283.456
• DSSTox Substance ID: DTXSID30919196
• Nikkaji Number: J49.777K
• Mol file: 924-08-3.mol

Synonyms:924-08-3;WR 2386;BRN 2368332;2-(4-Nonyl)aminoethanethiol hydrogen sulfate (ester);DTXSID30919196;Ethanethiol, 2-(4-nonyl)amino-, hydrogen sulfate (ester);Ethanethiol, 2-((1-propylhexyl)amino)-, hydrogen sulfate (ester);S-{2-[(Nonan-4-yl)amino]ethyl} hydrogen sulfurothioate

Chemical Property of Thiosulfuric acid, S-(2-((1-propylhexyl)amino)ethyl) ester

Chemical Property:

• Density: 1.125g/cm³
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 11
• Exact Mass: 283.12758601
• Heavy Atom Count: 17
• Complexity: 262

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCC(CCC)NCCSS(=O)(=O)O

Technology Process of Thiosulfuric acid, S-(2-((1-propylhexyl)amino)ethyl) ester

There total 1 articles about Thiosulfuric acid, S-(2-((1-propylhexyl)amino)ethyl) ester 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:

4-bromononane (52708-14-2) + ethanolamine (141-43-5) → 2--ethanthioschwefelsaeure (924-08-3)

Guidance literature:

Multistep reaction; (i) xylene, (ii) aq. HBr, (iii) aq. Na₂S₂O₃, EtOH;

DOI:10.1021/jm00336a041

upstream raw materials:

4-bromononane

ethanolamine