Ethanamine, 2-(butylthio)-

Base Information

• Chemical Name: Ethanamine, 2-(butylthio)-
• CAS No.: 3581-01-9
• Molecular Formula: C₆H₁₅NS
• Molecular Weight: 133.258
• Hs Code.: 2930909090
• NSC Number: 194880
• DSSTox Substance ID: DTXSID60307744
• Nikkaji Number: J341.517A
• Wikidata: Q82055277
• Mol file: 3581-01-9.mol

Synonyms:3581-01-9;Ethanamine, 2-(butylthio)-;2-(Butylthio)ethanamine hydrochloride;NSC194880;Ethanamine,2-(butylthio)-;SCHEMBL5242871;DTXSID60307744;AKOS000175305;NSC-194880

Chemical Property of Ethanamine, 2-(butylthio)-

Chemical Property:

• Vapor Pressure: 0.345mmHg at 25°C
• Refractive Index: 1.481
• Boiling Point: 199.2 °C at 760 mmHg
• Flash Point: 74.3 °C
• PSA: 51.32000
• Density: 0.917g/cm³
• LogP: 2.17870
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 133.09252066
• Heavy Atom Count: 8
• Complexity: 39.5

Purity/Quality:

99% ^*data from raw suppliers

2-(butylthio)ethanamine 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCSCCN

Technology Process of Ethanamine, 2-(butylthio)-

There total 5 articles about Ethanamine, 2-(butylthio)- 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: 73.0%

1-bromo-butane (109-65-9) + 2-mercaptoethylamine hydrochloride (156-57-0) → 2-(butylthio)ethanamine (3581-01-9)

Guidance literature:

With sodium hydroxide; In methanol; at 20 ℃; for 24h;

DOI:10.1002/bkcs.12341

Reference yield: 72.0%

1-bromo-butane (109-65-9) + Cysteamine (60-23-1) → 2-(butylthio)ethanamine (3581-01-9)

Guidance literature:

In acetonitrile; Ambient temperature; electrooxidation, supporting electrolyte Et₄NBr;

DOI:10.1055/s-1990-27030

Reference yield:

n-butanethiol (109-79-5) + 2-bromoethylamine hydrobromide (2576-47-8) → 2-(butylthio)ethanamine (3581-01-9)

Guidance literature:

With sodium ethanolate;

DOI:10.1021/ja01243a046

upstream raw materials:

ethyleneimine

n-butanethiol

2-bromoethylamine hydrobromide

1-bromo-butane

Downstream raw materials:

benzylidene-(2-butylsulfanyl-ethyl)-amine

3-(2-butylsulfanyl-ethyl)-2-phenyl-thiazolidin-4-one

Cyclohex-1-ene-1,2-dicarboxylic acid 1-[(2-butylsulfanyl-ethyl)-amide] 2-[(4-chloro-2-fluoro-phenyl)-amide]

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