3-[(1R,5S)-2-Methyl-2-Azabicyclo[3.3.1]Non-5-Yl]Phenol

Molecule SVG Image

Properties Simple | Detailed

Formula C15H21NO
IUPAC Name 3-[(1r,2s,5s)-2-methyl-2-azabicyclo[3.3.1]nonan-5-yl]phenol
Molecular Mass 231.333 g·mol−1
Heat of Formation -142.5 ± 16.7 kJ·mol−1
Dipole Moment 2.90 ± 1.08 D
Volume 295.74 Å 3
Surface Area 257.68 Å 2
HOMO Energy -8.58 ± 0.55 eV
LUMO Energy 0.17 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-5-m-hydroxyphenyl-2-methylmorphan
  • (-)-m-(2-methyl-2-azabicyclo(3.3.1)non-5-yl)phenol
  • 3-[(1s,5r)-4-methyl-4-azabicyclo[3.3.1]nonan-1-yl]phenol
  • phenol, 3-(2-methyl-2-azabicyclo(3.3.1)non-5-yl)-, (-)-
  • phenol, m-(2-methyl-2-azabicyclo(3.3.1)non-5-yl)-, (-)-
CAS Number(s)
  • 28623-84-9
InChIKey ZQJGRSYDDMBMPJ-HIFRSBDPSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N