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5-(Hydroxymethyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one(CAS: 93185-31-0)

5-(Hydroxymethyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
CAS Number

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Basic Information

Molecular Formula
C5H6N2O2S
Molecular Weight
158.18 g/mol

Physical Properties

Density
1.55±0.1 g/cm3 (20 ºC 760 Torr),

Chemical Identifiers

SMILES
C1=C(C(=O)NC(=S)N1)CO
InChIKey
ANMAXDCIDVNRHA-UHFFFAOYSA-N

Database References

FAQ

5-(Hydroxymethyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is a crystalline solid with a molecular weight of approximately 162.02 g/mol. It is poorly soluble in water but soluble in organic solvents like methanol and ethanol. This compound is reactive and can participate in nucleophilic substitution reactions. It may also undergo hydrolysis under basic conditions.
5-(Hydroxymethyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is commonly synthesized via the condensation of 2-thiohydantoin with an α-hydroxy aldehyde in the presence of a suitable base. The reaction typically involves a selectivity for the α-position and yields around 85-90%.
5-(Hydroxymethyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is used in the pharmaceutical industry for the development of certain drugs due to its biological activity. It is also of interest in the chemical industry for the synthesis of polymers and in sensor technology for its chemical reactivity.
When handling 5-(Hydroxymethyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one, it is important to wear appropriate personal protective equipment (PPE), including gloves and safety glasses. Store it in a dry, well-ventilated area away from incompatible materials and heat sources. Spills should be handled according to the Material Safety Data Sheet (MSDS) and local regulations. Ensure proper fume hood use during handling to minimize exposure risk.

Safety Notice

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

Always follow proper handling procedures

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