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CAS 1234-22-6

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1H-Azepine, 1,1′-(1,4-cyclohexylenedimethylene)bis[hexahydro-, dihydrochloride, trans-

Description:
1H-Azepine, 1,1′-(1,4-cyclohexylenedimethylene)bis[hexahydro-, dihydrochloride, trans- is a chemical compound characterized by its unique structure, which includes a bicyclic azepine framework and a cyclohexylene moiety. This compound is typically a white to off-white solid and is soluble in polar solvents, reflecting its ionic nature due to the presence of dihydrochloride groups. The azepine ring contributes to its potential biological activity, as compounds with such cyclic structures often exhibit interesting pharmacological properties. The presence of the hexahydro groups indicates saturation, which may influence the compound's reactivity and stability. Its trans configuration suggests specific stereochemical properties that can affect its interactions with biological targets. As with many chemical substances, safety data should be consulted, as it may pose hazards such as irritation or toxicity. Overall, this compound's structural features suggest potential applications in medicinal chemistry and materials science, warranting further investigation into its properties and uses.
Formula:C20H38N2·2ClH
InChI:InChI=1/C20H38N2.2ClH/c1-2-6-14-21(13-5-1)17-19-9-11-20(12-10-19)18-22-15-7-3-4-8-16-22;;/h19-20H,1-18H2;2*1H/t19-,20-;;
InChI key:InChIKey=JUSNIEPCJNWQRR-RKQOQJRBNA-N
SMILES:C(N1CCCCCC1)[C@H]2CC[C@H](CN3CCCCCC3)CC2.Cl
Synonyms:
  • Hexamethylenimine, 1,1′-(1,4-cyclohexylenedimethylene)di-, dihydrochloride, trans-
  • 1H-Azepine, 1,1′-(1,4-cyclohexylenedimethylene)bis[hexahydro-, dihydrochloride, trans-
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