(2A,6A,11R*)-1,2,3,4,5,6-Hexahydro-6,11-Dimethyl-3-(3-Methyl-2-Butenyl)-2,6-Methano-3-Benzazocin-8-Ol

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Properties Simple | Detailed

Formula C19H27NO
IUPAC Name (2a,6a,11r*)-1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-(3-methyl-2-butenyl)-2,6-methano-3-benzazocin-8-ol
Molecular Mass 285.424 g·mol−1
Heat of Formation -177.4 ± 16.7 kJ·mol−1
Dipole Moment 2.51 ± 1.08 D
Volume 376.16 Å 3
Surface Area 317.07 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy 0.27 ± eV
Point Group Symmetry C1
Synonyms
  • (2r*,6r*,11r*)-1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-(3-methyl-2-butenyl)-2,6-methano-3-benzazocin-8-ol
  • 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-(3-methyl-2-butenyl)-2,6-methano-3-benzazocin-8-ol
  • 2'-hydroxy-5,9-dimethyl-2-(3,3-dimethylallyl)-6,7-benzomorphan
  • 2,6-methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-(3-methyl-2-butenyl)-
  • 2,6-methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-(3-methyl-2-butenyl)-, (2alpha, 6alpha,11r*)-
  • 2,6-methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-(3-methyl-2-butenyl)-, (2alpha,6alpha,11r*)-
  • 2-(3,3-dimethylallyl)-2',2'-hydroxy-5,9-dimethyl-6,7-benzomorphan
  • 2-(3,3-dimethylallyl)cyclazocine
  • 2-dimethylallyl-5,9-dimethyl-2'-hydroxybenzomorphan
  • 3-(3-methyl-2-butenyl)-1,2,3,4,5,6-hexahydro-6,11-dimethyl-2,6-methano-3-benzazocin-8-ol
  • fortalgesic
  • fortalin
  • fortral
  • ii-c-2
  • kf-1820
  • liticon
  • nih 7958
  • pdsp2_001111
  • pentagin
  • pentazocin
  • pentazocina [dcit]
  • pentazocine
  • pentazocine, pentazocin, sosegon, win 20228
  • sosigon
  • win 20228
CAS Number(s)
  • 359-83-1
InChIKey VOKSWYLNZZRQPF-NIKGAXFTSA-N
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