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CAS 892502-26-0

:

ethyl 4-(4-methyl-1,4-diazepan-1-yl)benzoate

Description:
Ethyl 4-(4-methyl-1,4-diazepan-1-yl)benzoate is a chemical compound characterized by its unique structure, which includes an ethyl ester group and a diazepane moiety. This compound features a benzoate functional group, indicating it is derived from benzoic acid, with an ethyl group attached to the oxygen atom of the carboxylate. The presence of the 1,4-diazepane ring contributes to its potential biological activity, as diazepanes are known for their involvement in various pharmacological effects. The compound is likely to be a white to off-white solid or a liquid, depending on its purity and specific conditions. Its solubility may vary, but it is generally expected to be soluble in organic solvents. The molecular structure suggests potential applications in medicinal chemistry, particularly in the development of new therapeutic agents. As with many organic compounds, safety and handling precautions should be observed, as the specific toxicity and reactivity profiles would depend on the compound's interactions with biological systems and environmental factors.
Formula:C15H22N2O2
InChI:InChI=1/C15H22N2O2/c1-3-19-15(18)13-5-7-14(8-6-13)17-10-4-9-16(2)11-12-17/h5-8H,3-4,9-12H2,1-2H3
SMILES:CCOC(=O)c1ccc(cc1)N1CCCN(C)CC1
Synonyms:
  • Ethyl 4-(4-Methylperhydro-1,4-Diazepin-1-Yl)Benzoate
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