2-Methyl-2-sulfanylpropan-1-ol

Base Information

• Chemical Name: 2-Methyl-2-sulfanylpropan-1-ol
• CAS No.: 73303-88-5
• Molecular Formula: C4H10OS
• Molecular Weight: 106.189
• European Community (EC) Number: 828-429-6
• DSSTox Substance ID: DTXSID30501070
• Wikidata: Q82353182
• Mol file: 73303-88-5.mol

Synonyms:2-methyl-2-sulfanylpropan-1-ol;73303-88-5;2-Mercapto-2,2-dimethylethanol;SCHEMBL2957217;2-Mercapto-2-methylpropan-1-ol;DTXSID30501070;AKOS030254958;BS-52551;CS-0159069;E74700;EN300-220914

Chemical Property of 2-Methyl-2-sulfanylpropan-1-ol

Chemical Property:

• PSA: 59.03000
• LogP: 0.68710
• Storage Temp.: -20°C Freezer, Under inert atmosphere
• Solubility.: Chloroform, Methanol
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 106.04523611
• Heavy Atom Count: 6
• Complexity: 42.8

Purity/Quality:

97% ^*data from raw suppliers

2-Mercapto-2,2-dimethylethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(CO)S
• Uses: 2-Mercapto-2,2-dimethylethanol is a useful synthetic intermediate and a derivative of 2-Mercaptoethanol (M225480); a compound used in the synthesis of nano-graphene for cellular imaging and drug delivery. 2-Mercaptoethanol is also used in the synthesis of multifunctional polymeric micelles used in specific targeting of tumor disruption.

Technology Process of 2-Methyl-2-sulfanylpropan-1-ol

There total 6 articles about 2-Methyl-2-sulfanylpropan-1-ol 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: 89.0%

2,2'-dithiobis(2-methylpropanal) (15581-80-3) → 2-methyl-1-hydroxypropane-2-thiol (73303-88-5)

Guidance literature:

2,2'-dithiobis(2-methylpropanal); With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 20 ℃; for 3h;

With water; sodium sulfate; In tetrahydrofuran; at 20 ℃; for 0.166667h;

Reference yield: 40.0%

2,2'-dithiobis(2-mercapto-2-methylpropan-1-ol) (132182-01-5) → 2-methyl-1-hydroxypropane-2-thiol (73303-88-5)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; for 1h;

DOI:10.1021/ja00154a001

Reference yield:

2-acetylsulfanyl-2-methylpropionic acid ethyl ester (1151713-51-7) → 2-methyl-1-hydroxypropane-2-thiol (73303-88-5)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 80 ℃; for 2h;

upstream raw materials:

1-acetoxy-2-acetylsulfanyl-2-methyl-propane

trimethylsilyl 2-(methoxycarbonyl)-2-propanesulfinate

2,2'-dithiobis(2-mercapto-2-methylpropan-1-ol)

2,2'-dithiobis(2-methylpropanal)

Downstream raw materials:

4,4-Dimethyl-2-n-hexyl-1,3-oxathiolane

4,4-Dimethyl-2-(tetrahydro-furan-2-yl)-[1,3]oxathiolane

4,4-Dimethyl-2-non-8-en-3-ynyl-[1,3]oxathiolane

4,4-Dimethyl-1,3-dioxathiolane

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