Dimethyl(2-sulfanylethyl)azanium;chloride

Base Information

• Chemical Name: Dimethyl(2-sulfanylethyl)azanium;chloride
• CAS No.: 13242-44-9
• Molecular Formula: C4H11 N S . Cl H
• Molecular Weight: 141.665
• Hs Code.: 29309090
• Mol file: 13242-44-9.mol

Synonyms:dimethyl(2-sulfanylethyl)azanium;chloride;n,n-dimethyl-2-mercaptoethylammonium chloride

Chemical Property of Dimethyl(2-sulfanylethyl)azanium;chloride

Chemical Property:

• Appearance/Colour: white to off-white crystalline powder
• Vapor Pressure: 14.3mmHg at 25°C
• Melting Point: 150-160 °C(lit.)
• Boiling Point: 121.9°Cat760mmHg
• Flash Point: 27.5°C
• PSA: 42.04000
• Density: g/cm³
• LogP: 1.27980
• Storage Temp.: Refrigerator (+4°C)
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 141.0378983
• Heavy Atom Count: 7
• Complexity: 28.7

Purity/Quality:

97% ^*data from raw suppliers

2-(Dimethylamino)ethanethiol hydrochloride ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C[NH+](C)CCS.[Cl-]

Technology Process of Dimethyl(2-sulfanylethyl)azanium;chloride

There total 2 articles about Dimethyl(2-sulfanylethyl)azanium;chloride 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-chloroethyl)dimethylamine hydrochloride (4584-46-7) → 2-(N,N-dimethylamino)ethylthiol hydrochloride (13242-44-9)

Guidance literature:

(2-chloroethyl)dimethylamine hydrochloride; With sodium thiosulfate; In water; for 10h; Heating;

With hydrogenchloride; at 85 ℃; for 2h; Further stages.;

DOI:10.1021/ja800800p

Reference yield:

→ 2-(N,N-dimethylamino)ethylthiol hydrochloride (13242-44-9)

Guidance literature:

Reference yield: 90.42%

N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methyl-1H-indole-3-yl)-pyrimidine-2-amine (1421372-94-2) + 2-(N,N-dimethylamino)ethylthiol hydrochloride (13242-44-9) → N-(4-((2-(dimethylamino)ethyl)thio)-2-methoxy-5-nitrophenyl)-4-(1-methyl-1H-indol-3-yl)pyrimidin-2-amine

Guidance literature:

2-(N,N-dimethylamino)ethylthiol hydrochloride; With sodium hydride; In N,N-dimethyl-formamide; at 20 ℃; for 0.75h; Inert atmosphere;

N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methyl-1H-indole-3-yl)-pyrimidine-2-amine; In N,N-dimethyl-formamide; Inert atmosphere;

upstream raw materials:

(2-chloroethyl)dimethylamine hydrochloride

Downstream raw materials:

N-Benzyl-dithiocarbaminsaeure-(2-dimethylamino-ethylester)

3-(2-Dimethylamino-aethylmercapto)-rifamycin SV

[2-(8-chloro-10,11-dihydro-dibenzo[b,f]thiepin-10-ylsulfanyl)-ethyl]-dimethyl-amine

Dimethyl-[2-(7-methyl-3-phenyl-quinolin-2-ylsulfanyl)-ethyl]-amine