1-Azocanyl(3,4,5-Trimethoxyphenyl)Methanone

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Properties Simple | Detailed

Formula C17H25NO4
IUPAC Name azocan-1-yl-(3,4,5-trimethoxyphenyl)methanone
Molecular Mass 307.385 g·mol−1
Heat of Formation -608.1 ± 16.7 kJ·mol−1
Dipole Moment 4.42 ± 1.08 D
Volume 377.13 Å 3
Surface Area 321.96 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy 0.07 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(3,4,5-trimethoxybenzoyl)octahydroazocine
  • 1-azocanyl-(3,4,5-trimethoxyphenyl)methanone
  • azocine, octahydro-1-(3,4,5-trimethoxybenzoyl)-
  • ivk/0055139
  • n 1157
  • n-(3,4,5-trimethoxybenzoyl)azacyclooctane
  • n-(3,4,5-trimethoxybenzoyl)heptamethyleneimine
  • n-(3,4,5-trimethoxybenzoyl)heptamethylenimine
  • n-1157
  • n-3,4,5-trimethoxybenzoyl-heptamethylene imine
  • n-3,4,5-trimethoxybenzoylheptamethylenimine
  • octahydro-1-(3,4,5-trimethoxybenzoyl)azocine
  • origen
  • origon
  • trocimine
CAS Number(s)
  • 14368-24-2
InChIKey WZSDNEJJUSYNSG-UHFFFAOYSA-N
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