Cyclopentyl-1-thiaethane

Base Information

• Chemical Name: Cyclopentyl-1-thiaethane
• CAS No.: 7133-36-0
• Molecular Formula: C6H12S
• Molecular Weight: 116.2245
• DSSTox Substance ID: DTXSID10221522
• Nikkaji Number: J95.505A
• Wikidata: Q83099328
• Mol file: 7133-36-0.mol

Synonyms:Cyclopentyl-1-thiaethane;7133-36-0;CYCLOPENTYLMETHYLSULFIDE;Methylsulfanylcyclopentane;Sulfide, cyclopentyl methyl;(Methylsulfanyl)cyclopentane;Cyclopentyl methyl sulfide;Cyclopentane, (methylthio)-;Methylthiocyclopentane;methylsulanylcyclopentane;cyclopentyl(methyl)sulfane;Methyl cyclopentyl sulfide;Cyclopentyl methyl sulphide;SCHEMBL722771;DTXSID10221522;CHEBI:167076;OTQVGYMGQKHLMY-UHFFFAOYSA-N;AKOS006241264;FT-0693183;EN300-372578

Chemical Property of Cyclopentyl-1-thiaethane

Chemical Property:

• Vapor Pressure: 3.39mmHg at 25°C
• Melting Point: -103.81°C
• Refractive Index: 1.4921 (estimate)
• Boiling Point: 158.5°Cat760mmHg
• Flash Point: 43.1°C
• PSA: 25.30000
• Density: 0.94g/cm³
• LogP: 2.29200
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 116.06597156
• Heavy Atom Count: 7
• Complexity: 46.1

Purity/Quality:

99% ^*data from raw suppliers

CYCLOPENTYLMETHYLSULFIDE 98.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC1CCCC1

Technology Process of Cyclopentyl-1-thiaethane

There total 4 articles about Cyclopentyl-1-thiaethane 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:

Dimethyldisulphide (624-92-0) + cyclopentene (142-29-0) → cyclopentyl methyl sulfide (7133-36-0)

Guidance literature:

With [4,4′-bis(1,1-dimethylethyl)-2,2′-bipyridine-N1,N1′]bis{3,5-difluoro-2-[5-(trifluoromethyl)-2-pyridinyl-κN]phenyl-κC}iridium(III) hexafluorophosphate; In 1,2-dichloro-ethane; at 20 ℃; for 16h; chemoselective reaction; Irradiation;

DOI:10.1038/s41557-018-0102-z

Reference yield:

Cyclopentyl bromide (137-43-9) → cyclopentyl methyl sulfide (7133-36-0)

Guidance literature:

Multi-step reaction with 2 steps

1: alcohol; potassium hydrosulfide

2: sodium ethylate

With ethanol; sodium ethanolate; potassium hydrosulfide;

Reference yield:

cyclopentylthiol (1679-07-8) + methyl iodide (74-88-4) → cyclopentyl methyl sulfide (7133-36-0)

Guidance literature:

With sodium ethanolate;

upstream raw materials:

cyclopentylthiol

methyl iodide

methylthiol

cyclopentanone

Refernces