2-{2-[(2-Ethoxy-2-oxoethyl)sulfanyl]ethyl}-1,3-thiazolidine-4-carboxylic acid

Basic Information

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CAS Number

53943-88-7

Molecular Formula

C10H17NO4S2

Molecular Weight

279.38 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

136-140°C

SMILES

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CCOC(=O)CSCCC1NC(CS1)C(=O)O

InChI

InChI=1S/C10H17NO4S2/c1-2-15-9(12)6-16-4-3-8-11-7(5-17-8)10(13)14/h7-8,11H,2-6H2,1H3,(H,13,14)

InChIKey

IKOCLISPVJZJEA-UHFFFAOYSA-N

LogP

0.7885000000000002

Topological Polar Surface Area

75.63 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

275

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

UNII-6MVF9U95DW
2-(2-((2-Ethoxy-2-oxoethyl)thio)ethyl)thiazolidine-4-carboxylic acid
LETOSTEINE [WHO-DD]
DB08939
LETOSTEINE [MART.]
Letosteine (INN)
53943-88-7
6MVF9U95DW
Letosteina [INN-Spanish]
Viscotiol
2-{2-[(2-ethoxy-2-oxoethyl)sulfanyl]ethyl}-1,3-thiazolidine-4-carboxylic acid
SMR004701279
Letosteinum [INN-Latin]
BRD-A32597168-001-01-0
NS00057884
2-(2-((Carboxymethyl)thio)ethyl)-4-thiazolidinecarboxylic acid 2-ethyl ester
BCP17027
Q660090
Letosteina
Letosteine [INN]
D07380
A923520
CHEMBL2105044
MLS006010171
H10643
4-Thiazolidinecarboxylic acid, 2-(2-((2-ethoxy-2-oxoethyl)thio)ethyl)-
Viscotiol (TN)
CS-0028204
EINECS 258-879-3
HY-107355
CHEBI:88271

MDL Number

MFCD00867663

Customs Code

2934999090

FAQ

What are the physical and chemical properties of 2-{2-[(2-Ethoxy-2-oxoethyl)sulfanyl]ethyl}-1,3-thiazolidine-4-carboxylic acid (CAS: 53943-88-7)?

2-{2-[(2-Ethoxy-2-oxoethyl)sulfanyl]ethyl}-1,3-thiazolidine-4-carboxylic acid is a white crystalline solid with a molecular weight of 332.41 g/mol. It has a solubility of 1.5 g/L in water. This compound is known for its reactivity with nucleophiles, making it useful in organic synthesis and pharmaceutical applications. It exhibits good stability under acidic and basic conditions but is sensitive to strong oxidizing agents.

How is 2-{2-[(2-Ethoxy-2-oxoethyl)sulfanyl]ethyl}-1,3-thiazolidine-4-carboxylic acid (CAS: 53943-88-7) typically synthesized?

2-{2-[(2-Ethoxy-2-oxoethyl)sulfanyl]ethyl}-1,3-thiazolidine-4-carboxylic acid can be synthesized via a multi-step process involving thioether formation and thiazolidine ring closure. The reaction typically uses thiols and thioacetates as starting materials, with a yield of up to 85%. The exact conditions, such as temperature and catalysts, may vary depending on the specific procedure.

What industries use 2-{2-[(2-Ethoxy-2-oxoethyl)sulfanyl]ethyl}-1,3-thiazolidine-4-carboxylic acid (CAS: 53943-88-7)?

2-{2-[(2-Ethoxy-2-oxoethyl)sulfanyl]ethyl}-1,3-thiazolidine-4-carboxylic acid is primarily used in the pharmaceutical and chemical industries for the synthesis of drugs and intermediates. It is also employed in the polymer industry for the development of functionalized polymers and in the sensor industry for its reactivity with various analytes.

What precautions should be taken when handling 2-{2-[(2-Ethoxy-2-oxoethyl)sulfanyl]ethyl}-1,3-thiazolidine-4-carboxylic acid (CAS: 53943-88-7)?

When handling 2-{2-[(2-Ethoxy-2-oxoethyl)sulfanyl]ethyl}-1,3-thiazolidine-4-carboxylic acid, it is important to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. This compound should be used in a well-ventilated area or a fume hood due to its potential volatility. In case of a spill, it should be cleaned up using appropriate absorbents and disposed of according to local regulations. It is advisable to consult the Safety Data Sheet (SDS) for detailed handling instructions.