Ethanol, 2-[2-(2-mercaptoethoxy)ethoxy]-


Chemical Name: Ethanol, 2-[2-(2-mercaptoethoxy)ethoxy]-
CAS Number: 56282-36-1
Product Number: AG00DFG6(AGN-PC-0JSPIG)
Synonyms:
MDL No:
Molecular Formula: C6H14O3S
Molecular Weight: 166.2386

Identification/Properties


Properties
BP:
100°C/0.1 Torr
Storage:
-10 ℃;Inert atmosphere;
Computed Properties
Molecular Weight:
166.235g/mol
XLogP3:
-0.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
7
Exact Mass:
166.066g/mol
Monoisotopic Mass:
166.066g/mol
Topological Polar Surface Area:
39.7A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
61
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



3,6-Dioxa-8-mercaptooctan-1-ol is a versatile compound widely used in chemical synthesis for its unique properties and reactivity. This compound plays a crucial role in various organic reactions, serving as a key building block in the creation of complex molecular structures. One important application of 3,6-Dioxa-8-mercaptooctan-1-ol is in the formation of sulfur-containing compounds, where its mercapto group can participate in thiol-disulfide exchange reactions. This allows for the incorporation of sulfur atoms into organic molecules, enabling the synthesis of sulfides, disulfides, and other sulfur-containing functional groups.Additionally, 3,6-Dioxa-8-mercaptooctan-1-ol is often utilized as a linker molecule in the construction of organic frameworks. Its unique structure, containing both ether and thiol functional groups, provides multiple points of attachment for further chemical modification. This flexibility makes it a valuable tool for building molecular architectures with specific functionalities and properties.Furthermore, the hydroxyl group in 3,6-Dioxa-8-mercaptooctan-1-ol can act as a nucleophile in organic reactions, participating in processes such as esterification and ether formation. This reactivity expands the compound's synthetic utility, allowing for the introduction of diverse functional groups and enhancing its potential applications in organic chemistry.In conclusion, 3,6-Dioxa-8-mercaptooctan-1-ol is a versatile compound with valuable applications in chemical synthesis. Its unique structure and reactivity make it a valuable building block for the construction of complex molecular structures and the preparation of sulfur-containing compounds.