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CAS 90673-37-3

:

Hexahydro-7-methyl-5H-1,4-diazepin-5-one

Description:
Hexahydro-7-methyl-5H-1,4-diazepin-5-one, with the CAS number 90673-37-3, is a cyclic organic compound characterized by its diazepine structure, which consists of a seven-membered ring containing two nitrogen atoms. This compound typically exhibits a colorless to pale yellow appearance and is soluble in organic solvents. Its molecular structure includes a methyl group at the 7-position and a carbonyl group at the 5-position, contributing to its reactivity and potential applications in organic synthesis. Hexahydro-7-methyl-5H-1,4-diazepin-5-one may serve as an intermediate in the synthesis of pharmaceuticals or agrochemicals, owing to the presence of the diazepine framework, which is known for its biological activity. Additionally, the compound's stability and reactivity can be influenced by the presence of substituents on the ring, making it a subject of interest in medicinal chemistry. Safety data should be consulted for handling and usage, as with any chemical substance.
Formula:C6H12N2O
InChI:InChI=1S/C6H12N2O/c1-5-4-6(9)8-3-2-7-5/h5,7H,2-4H2,1H3,(H,8,9)
InChI key:InChIKey=BJPCEVKBOAXMAH-UHFFFAOYSA-N
SMILES:CC1CC(=O)NCCN1
Synonyms:
  • 7-Methyl-1,4-diazepan-5-one
  • 5H-1,4-Diazepin-5-one, hexahydro-7-methyl-
  • 7-Methyl-5-oxo-1,4-diazepane
  • Hexahydro-7-methyl-5H-1,4-diazepin-5-one
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