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2-((5-Bromopyrimidin-2-yl)thio)acetic acid(CAS: 52767-92-7)

2-((5-Bromopyrimidin-2-yl)thio)acetic acid
CAS Number

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Basic Information

Molecular Formula
C6H5BrN2O2S
Molecular Weight
249.09 g/mol

Chemical Identifiers

SMILES
C1=C(C=NC(=N1)SCC(=O)O)Br
InChIKey
GEFXJQVEMVQMSS-UHFFFAOYSA-N

Database References

MDL Number
MFCD09754081

FAQ

2-((5-Bromopyrimidin-2-yl)thio)acetic acid has a crystalline form with a molecular weight of approximately 270.02 g/mol. It is practically insoluble in water but soluble in organic solvents like DMSO and acetonitrile. Chemically, it shows moderate reactivity towards nucleophiles and can undergo substitution reactions. It is also susceptible to hydrolysis under basic conditions.
2-((5-Bromopyrimidin-2-yl)thio)acetic acid is typically synthesized through a multi-step process involving the bromination of pyrimidine followed by thioetherification with acetic acid. Commonly used catalysts include sulfuric acid, and the reaction is conducted under reflux conditions to achieve high yields. The product is purified through recrystallization or column chromatography.
2-((5-Bromopyrimidin-2-yl)thio)acetic acid is primarily used in pharmaceuticals for developing antiviral and anticancer drugs. It also finds applications in the synthesis of polymer additives, where its thioether functionality can improve the performance of polymer materials. Additionally, it is explored in the field of sensors for detecting specific chemical compounds.
When handling 2-((5-Bromopyrimidin-2-yl)thio)acetic acid (CAS: 52767-92-7), appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat should be worn. Work should be conducted in a well-ventilated area or fume hood. Spills should be managed using appropriate absorbent materials, and the area should be thoroughly cleaned. Always consult the Safety Data Sheet (SDS) for specific handling instructions and emergency procedures.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

Contact Information

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