Amyl methyl sulfide

Base Information

• Chemical Name: Amyl methyl sulfide
• CAS No.: 1741-83-9
• Molecular Formula: C6H14S
• Molecular Weight: 118.243
• Hs Code.: 2930909090
• European Community (EC) Number: 672-714-6
• NSC Number: 164935
• DSSTox Substance ID: DTXSID00169762
• Nikkaji Number: J44.102C
• Wikidata: Q83039503
• Mol file: 1741-83-9.mol

Synonyms:Amyl methyl sulfide;1741-83-9;n-Amyl methyl sulfide;Pentane, 1-(methylthio)-;METHYL PENTYL SULFIDE;1-methylsulfanylpentane;Sulfide, methyl pentyl;2-Thiaheptane;Methylthiapentane;1-(Methylthio)pentane;Methyl n-pentyl sulfide;Amyl methylsulfide;methyl(pentyl)sulfane;Pentyl methyl sulfide;1-methylsulanylpentane;Methyl n-amyl sulfide;Methyl pentyl sulphide;AMYLMETHYLSULFIDE;C(CCC)CSC;1-(Methylsulfanyl)pentane #;SCHEMBL198977;SCHEMBL7096729;DTXSID00169762;CHEBI:167077;FOJGPFUFFHWGFQ-UHFFFAOYSA-N;MFCD00027274;NSC164935;AKOS024429053;NSC 164935;NSC-164935;BS-21737;A0452;FT-0633813;D88262;InChI=1/C6H14S/c1-3-4-5-6-7-2/h3-6H2,1-2H

Chemical Property of Amyl methyl sulfide

Chemical Property:

• Vapor Pressure: 0.735mmHg at 25°C
• Melting Point: -94 °C
• Refractive Index: 1.501
• Boiling Point: 145 °C at 760 mmHg
• Flash Point: 39.7 °C
• PSA: 25.30000
• Density: 0.835 g/cm³
• LogP: 2.53960
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 118.08162162
• Heavy Atom Count: 7
• Complexity: 27.4

Purity/Quality:

99% ^*data from raw suppliers

Amyl Methyl Sulfide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCSC

Technology Process of Amyl methyl sulfide

There total 7 articles about Amyl methyl sulfide 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: 78.0%

n-pentanethiol (110-66-7) + methyl iodide (74-88-4) → 1-(methylthio)pentane (1741-83-9)

Guidance literature:

With silica gel; at 20 ℃; for 6h;

DOI:10.1039/b925620b

Reference yield:

(C6H11)2BCH2S(n-C5H11) → 1-(methylthio)pentane (1741-83-9)

Guidance literature:

With trimethylamine-N-oxide; at 25 ℃; for 12h;

DOI:10.1039/b311292f

Reference yield:

n-pentanethiol (110-66-7) + diethylene glycol dimethyl ether (111-96-6) → 1-(methylthio)pentane (1741-83-9)

Guidance literature:

Multistep reaction; (i) NaBH₄, (ii) /BRN= 1736101/;

DOI:10.1021/ja00962a021

upstream raw materials:

diamyl disulfide

betaine

n-pentanethiol

diethylene glycol dimethyl ether

Downstream raw materials:

dimethyl-pentyl sulfonium ; iodide

2-aminophenyl pentyl sulphide

Refernces

• 1、 Stoddard, Jonathan M.,Shea, Kenneth J.. "On the relative migratory aptitudes of carbon and heteroatoms in borate complexes. A surprising α-thia effect". . p. 830 - 831. Retrieved 2007/10/03.