3,3'-Sulfanediyldipropanoic acid

Basic Information

View in Editor

CAS Number

111-17-1

Molecular Formula

C6H10O4S

Molecular Weight

178.21 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Physical Properties

Melting Point

130.0 to 134.0 deg-C

Boiling Point

280.43°C (rough estimate)

Water Solubility

40 g/L (25 ºC)

Solubility

40g/l

Refractive Index

1.5500 (estimate)

Vapor Pressure

0.0±2.0 mmHg at 25°C

SMILES

View in Editor

OC(=O)CCSCCC(=O)O

InChI

InChI=1S/C6H10O4S/c7-5(8)1-3-11-4-2-6(9)10/h1-4H2,(H,7,8)(H,9,10)

InChIKey

ODJQKYXPKWQWNK-UHFFFAOYSA-N

LogP

0.669

Topological Polar Surface Area

74.6 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

130

Safety Information

View Safety Information

GHS Hazard Pictograms

H319

Hazard Statement

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

3,3'-thiodi(propionic acid)
3,3'-Thiodipropionic acid
3,3'-Thiodipropanoic Acid
3.3'-Thiodipropionicacid
3-(2-carboxyethylsulfanyl)propanoic acid
3,4'-Thiodipropionic acid
Bis(2-carboxyethyl)sulfide
tyoxa
3.3'-Thiodipro
thiodipropionic
thiodipropionate
RARECHEM AL BO 0314
THIODIPROPIONIC ACID
THIODIHYDRACRYLIC ACID
4-thiaheptanedioicacid
Tyox A
LABOTEST-BB LT00254336
Bis(2-carboxyethyl) sulfide
Propanoic acid, 3,3'-thiobis-
4-Thiaheptanedioic acid
TDPA
Sulfide, bis(2-carboxyethyl)
3,3'-Thiobis(propanoic acid)
Propionic acid, 3,3'-thiodi-
Thiahydracrylic acid
Diethyl sulfide 2,2'-dicarboxylic acid
3,3-thiodipropionic acid
3-[(2-carboxyethyl)sulfanyl]propanoic acid
Kyselina 3,3-thiodipropionova
HSD

MDL Number

MFCD00002781

Customs Code

29309070

FAQ

What is 3,3'-Sulfanediyldipropanoic acid (CAS: 111-17-1)?

3,3'-Sulfanediyldipropanoic acid, with the CAS number 111-17-1, is a chemical compound consisting of two propanoic acid groups connected by a sulfane bridge. It is a white crystalline solid with a molecular formula of C6H12O4S and is commonly used in organic synthesis. The compound exhibits moderate solubility in water and is known for its stability under normal conditions.

What are the main uses of 3,3'-Sulfanediyldipropanoic acid (CAS: 111-17-1)?

3,3'-Sulfanediyldipropanoic acid is primarily used in the pharmaceutical industry as an intermediate in the synthesis of various drugs. It also finds applications in organic research, polymer chemistry, and industrial processes involving sulfur-containing compounds. Its unique structure makes it valuable for creating complex molecules with specific functional groups.

Is 3,3'-Sulfanediyldipropanoic acid (CAS: 111-17-1) safe?

3,3'-Sulfanediyldipropanoic acid is generally considered safe when handled properly, but it may cause mild irritation to the skin and eyes. Safety data sheets recommend using appropriate personal protective equipment (PPE) such as gloves and goggles. It is important to follow safety standards and ensure proper ventilation when working with this compound to minimize exposure risks.

How should 3,3'-Sulfanediyldipropanoic acid (CAS: 111-17-1) be stored?

3,3'-Sulfanediyldipropanoic acid should be stored in a cool, dry, and well-ventilated place, away from direct light. It is best kept in a sealed container to prevent moisture absorption and maintain its stability. Storage conditions should be controlled to avoid temperature fluctuations, ensuring optimal preservation of the compound's chemical integrity.