(1R,9R,13R)-1,13-Dimethyl-10-[(2-Methyl-3-Furyl)Methyl]-10-Azatricyclo[7.3.1.0~2,7~]Trideca-2,4,6-Trien-4-Ol

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Formula C20H25NO2
IUPAC Name (1r,9r,13r)-1,13-dimethyl-10-[(2-methyl-3-furyl)methyl]-10-azatricyclo[7.3.1.0 2,7 ]trideca-2,4,6-trien-4-ol
Molecular Mass 311.418 g·mol−1
Heat of Formation -226.8 ± 16.7 kJ·mol−1
Dipole Moment 2.62 ± 1.08 D
Volume 393.67 Å 3
Surface Area 326.24 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy 0.24 ± eV
Point Group Symmetry C1
Synonyms
  • 2,6-methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-((2-methyl-3-furanyl)methyl)-, (2-alpha,6-alpha,11r*)-(+-)-
  • alpha-5,9-dimethyl-2-(2-methyl-3-furylmethyl)-2'-hydroxy-6,7-benzomorphan
  • mr 1268
  • nih 8735
  • um 909
CAS Number(s)
  • 59203-74-6
InChIKey MTDCZKOSLIRABS-CJMONDIMSA-N
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