6-deoxy-6-mercapto-gamma-cyclodextrin,octakis

Basic Information

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CAS Number

180839-61-6

Molecular Formula

C48H80O32S8

Molecular Weight

1425.65 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Polymers and Plastics Thermoplastics Polyolefins

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Solubility

Soluble in DMF, DMSO. Insoluble in water, acetone, methanol, chloroform.

SMILES

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C(C1C2C(C(C(O1)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)OC5C(OC(C(C5O)O)OC6C(OC(C(C6O)O)OC7C(OC(C(C7O)O)OC8C(OC(C(C8O)O)OC9C(OC(O2)C(C9O)O)CS)CS)CS)CS)CS)CS)CS)O)O)S

InChI

InChI=1S/C48H80O32S8/c49-17-25(57)41-65-9(1-81)33(17)73-42-26(58)18(50)35(11(3-83)66-42)75-44-28(60)20(52)37(13(5-85)68-44)77-46-30(62)22(54)39(15(7-87)70-46)79-48-32(64)24(56)40(16(8-88)72-48)80-47-31(63)23(55)38(14(6-86)71-47)78-45-29(61)21(53)36(12(4-84)69-45)76-43-27(59)19(51)34(74-41)10(2-82)67-43/h9-64,81-88H,1-8H2

InChIKey

HXPYYCNJOWSHQQ-UHFFFAOYSA-N

LogP

-9.906400000000037

Topological Polar Surface Area

471.3600000000002 Å²

Hydrogen Bond Donor/Acceptor

16 / 32

Complexity

1750

Synonyms & References

English

Octakis-(6-Mercapto-6-deoxy)-γ-Cyclodextrin
γ-Cyclodextrin,6A,6B,6C,6D,6E,6F,6G,6H-octathio
Octakis(6-mercapto-6-deoxy)-gamma-cyclodextrin

FAQ

What are the physical and chemical properties of 6-deoxy-6-mercapto-gamma-cyclodextrin,octakis (CAS: 180839-61-6)?

6-Deoxy-6-mercapto-gamma-cyclodextrin,octakis (CAS: 180839-61-6) is a crystalline compound with a molecular weight of approximately 1224.6 g/mol. It has a solubility of about 0.1 g/L in water. This compound is known for its reactivity towards thiol groups and its ability to encapsulate hydrophobic molecules due to its cyclodextrin structure.

How is 6-deoxy-6-mercapto-gamma-cyclodextrin,octakis (CAS: 180839-61-6) typically synthesized?

6-Deoxy-6-mercapto-gamma-cyclodextrin,octakis (CAS: 180839-61-6) is usually synthesized through the reduction of 6-deoxy-gamma-cyclodextrin with sodium borohydride, followed by the introduction of a mercapto group. This process involves the use of appropriate solvents and temperature control to achieve high yield and selectivity.

What industries use 6-deoxy-6-mercapto-gamma-cyclodextrin,octakis (CAS: 180839-61-6)?

6-Deoxy-6-mercapto-gamma-cyclodextrin,octakis (CAS: 180839-61-6) is used in various industries including pharmaceuticals for drug delivery systems, polymers for controlled release applications, and sensors for detecting thiol-containing molecules. It also has potential applications in the field of semiconductors.

What precautions should be taken when handling 6-deoxy-6-mercapto-gamma-cyclodextrin,octakis (CAS: 180839-61-6)?

When handling 6-deoxy-6-mercapto-gamma-cyclodextrin,octakis (CAS: 180839-61-6), it is important to wear appropriate personal protective equipment (PPE) such as gloves and safety goggles. Ensure that the compound is stored in a cool, dry place and used in a well-ventilated area or fume hood to avoid inhalation. Always consult the Safety Data Sheet (SDS) for detailed handling instructions.