Methanethiol, N-(3-(3-indolyl)propyl)amidino-, hydrogen thiosulfate

Base Information

• Chemical Name: Methanethiol, N-(3-(3-indolyl)propyl)amidino-, hydrogen thiosulfate
• CAS No.: 13514-27-7
• Molecular Formula: C13H17N3O3S2
• Molecular Weight: 327.4224
• Hs Code.: 2933990090
• NSC Number: 187499
• DSSTox Substance ID: DTXSID00159264
• Nikkaji Number: J41.723H
• Mol file: 13514-27-7.mol

Synonyms:13514-27-7;Methanethiol, N-(3-(3-indolyl)propyl)amidino-, hydrogen thiosulfate;3-[3-[(1-amino-2-sulfosulfanylethylidene)amino]propyl]-1H-indole;Thiosulfuric acid, S-ester with N-(3-indol-3-ylpropyl)-2-mercaptoacetamidine;S-((N-(3-(3-Indolyl)propyl)amidino)methyl) hydrogen thiosulfate;Thiosulfuric acid hydrogen S-[2-[3-(1H-indol-3-yl)propylamino]-2-iminoethyl] ester;Thiosulfuric acid (H2S2O3), S-(2-imino-2-((3-(1H-indol-3-yl)propyl)amino)ethyl) ester;Thiosulfuric acid (H2S2O3), S-[2-imino-2-[[3-(1H-indol-3-yl)propyl]amino]ethyl] ester;NSC 187499;BRN 0443633;S-[[N-[3-(3-Indolyl)propyl]amidino]methyl] hydrogen thiosulfate;NSC187499;DTXSID00159264;WLN: T56 BMJ D3MYUM&1SSWQ;NSC-187499

Chemical Property of Methanethiol, N-(3-(3-indolyl)propyl)amidino-, hydrogen thiosulfate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 142.22000
• Density: 1.46g/cm³
• LogP: 3.77480
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 327.07113376
• Heavy Atom Count: 21
• Complexity: 462

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=CN2)CCCN=C(CSS(=O)(=O)O)N

Technology Process of Methanethiol, N-(3-(3-indolyl)propyl)amidino-, hydrogen thiosulfate

There total 1 articles about Methanethiol, N-(3-(3-indolyl)propyl)amidino-, hydrogen thiosulfate 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:

→ Thioschwefelsaeure-S-(2-<3-indolyl-(3)-propylamino>-2-imino-ethylester) (13514-27-7)

Guidance literature:

Natriumthiosulfat/wss. A., '-<3-Indolyl-(3)-propylamino>-2-imino-ethylchlorid-hydrochlorid/W. (80grad, 45 min);