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CAS 944905-88-8

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2-(Chloromethyl)-4(3H)-pyrimidinone

Description:
2-(Chloromethyl)-4(3H)-pyrimidinone is a heterocyclic organic compound characterized by its pyrimidinone structure, which features a pyrimidine ring with a carbonyl group and a chloromethyl substituent. This compound typically exhibits a pale yellow to off-white solid appearance and is soluble in polar organic solvents. The presence of the chloromethyl group enhances its reactivity, making it a useful intermediate in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals. The compound's molecular structure contributes to its potential biological activity, which may include antimicrobial or antiviral properties, although specific biological data may vary. As with many chlorinated compounds, it is important to handle 2-(Chloromethyl)-4(3H)-pyrimidinone with care due to potential toxicity and environmental concerns. Proper safety measures should be observed when working with this substance in laboratory settings.
Formula:C5H5ClN2O
InChI:InChI=1S/C5H5ClN2O/c6-3-4-7-2-1-5(9)8-4/h1-2H,3H2,(H,7,8,9)
InChI key:InChIKey=UHPUYOIOPLNWKU-UHFFFAOYSA-N
SMILES:C(Cl)C=1NC(=O)C=CN1
Synonyms:
  • 2-Chloromethylpyrimidin-4-ol
  • 2-(Chloromethyl)-4(3H)-pyrimidinone
  • 4(3H)-Pyrimidinone, 2-(chloromethyl)-
  • 2-(Chloromethyl)-1H-pyrimidin-6-one
  • 2-(Chloromethyl)-3,4-dihydropyrimidin-4-one
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