2,5-Dimethyl-1,4-dithiane-2,5-diol

Basic Information

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CAS Number

55704-78-4

Molecular Formula

C6H12O2S2

Molecular Weight

180.29 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

86.0 to 90.0 deg-C

Boiling Point

283.13°C (rough estimate)

Density

1.147 (estimate)

Flash Point

47 ºC

Refractive Index

1.5390 (estimate)

SMILES

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CC1(O)CSC(C)(O)CS1

InChI

InChI=1S/C6H12O2S2/c1-5(7)3-10-6(2,8)4-9-5/h7-8H,3-4H2,1-2H3

InChIKey

NHKIYYMFGJBOTK-UHFFFAOYSA-N

LogP

0.8834

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

126

Safety Information

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Sensitiveness

对光线和湿度敏感

Synonyms & References

English

2,5-Dimethyl-1,4-dithiane-2,5-diol
2,5-Dimethyl-2,5-dihydroxy-1,4-dithiane
dimeric mercapto propanone
2,5-dimethyl-2,5-dihydroxy-1,4-disulfocyclohexane
2,5-dihydroxy-2,5-dimethyl-1,4-dithiane
2,5-Dimethyl-2,5-dihydroxy-p-dithiane
1-Mercaptopropanone Dimer
2-Mercaptopropanone
1,4-Dithiane-2,5-diol, 2,5-dimethyl-
2,5-DIMETHYL-[1,4]DITHIANE-2,5-DIOL
2,5-Dimethyl-p-dithiane-2,5-diol
FEMA No. 3450
dimericmercaptopropanone
1-Mercaptopropanone (dimer)
meaty dithiane
NSC176174
2,5-Dimeth
dimeric mercaptopropanone
FEMA3450
Cyclodithalfarol-705
2,5-Dimethyl-2,5-dihydroxy-1,4-disulfocyclohexane
2,5-Dihydroxy-2,5-dimethyl-1,4-dithiane

MDL Number

MFCD00010121

Customs Code

2934999090

FAQ

What regulatory guidelines apply to 2,5-Dimethyl-1,4-dithiane-2,5-diol (CAS: 55704-78-4)?

2,5-Dimethyl-1,4-dithiane-2,5-diol (CAS: 55704-78-4) falls under the scope of various regulatory guidelines including GHS (Global Harmonized System of Classification and Labelling of Chemicals), REACH (Registration, Evaluation, Authorisation and Restriction of Chemicals) in the EU, and FDA and EPA regulations in the United States. Manufacturers and importers must ensure the substance is properly classified, labeled, and documented as per these guidelines to comply with international and national standards.

Are there alternatives to 2,5-Dimethyl-1,4-dithiane-2,5-diol (CAS: 55704-78-4) in synthesis?

There are several alternative reagents that can be used in the synthesis of compounds similar to 2,5-Dimethyl-1,4-dithiane-2,5-diol (CAS: 55704-78-4). These include 2,5-Dimethylthiophene-3,4-diol and other dithiane derivatives. These alternatives offer similar functionalities and can be chosen based on the specific requirements of the chemical synthesis process.

What is the market or research trend for 2,5-Dimethyl-1,4-dithiane-2,5-diol (CAS: 55704-78-4)?

The market for 2,5-Dimethyl-1,4-dithiane-2,5-diol (CAS: 55704-78-4) is primarily driven by its use in pharmaceuticals, agrochemicals, and as a precursor in organic synthesis. Research trends are focusing on its application in biocatalysis and as a building block for complex molecules. The increasing demand in these sectors is expected to drive market growth in the coming years.

How should waste containing 2,5-Dimethyl-1,4-dithiane-2,5-diol (CAS: 55704-78-4) be handled?

Waste containing 2,5-Dimethyl-1,4-dithiane-2,5-diol (CAS: 55704-78-4) should be collected in appropriately labeled containers and stored in a safe, well-ventilated area. Incineration or professional waste disposal services are recommended to ensure safe and environmentally friendly disposal. Proper environmental protection precautions must be taken to prevent contamination of soil and water sources during disposal and handling.