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CAS 5791-00-4

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6-chloro-2-methyl-2H-1,4-benzoxazin-3(4H)-one

Description:
6-Chloro-2-methyl-2H-1,4-benzoxazin-3(4H)-one, with the CAS number 5791-00-4, is a chemical compound belonging to the class of benzoxazines, which are characterized by a fused benzene and oxazine ring structure. This compound features a chlorine substituent at the 6-position and a methyl group at the 2-position of the benzoxazine ring. It is typically a solid at room temperature and is known for its potential applications in various fields, including agrochemicals and pharmaceuticals, due to its biological activity. The presence of the chloro and methyl groups can influence its reactivity and solubility, making it of interest for synthetic chemistry. Additionally, benzoxazines are often studied for their thermal stability and polymerization properties, which can be relevant in material science. Safety data sheets should be consulted for handling and storage guidelines, as with any chemical substance, to ensure safe laboratory practices.
Formula:C9H8ClNO2
InChI:InChI=1/C9H8ClNO2/c1-5-9(12)11-7-4-6(10)2-3-8(7)13-5/h2-5H,1H3,(H,11,12)
SMILES:CC1C(=Nc2cc(ccc2O1)Cl)O
Synonyms:
  • 2H-1,4-benzoxazin-3(4H)-one, 6-chloro-2-methyl-
  • 6-Chloro-2-methyl-2H-1,4-benzoxazin-3(4H)-one
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