Penbutolol

Molecule SVG Image

Properties Simple | Detailed

Formula C18H29NO2
IUPAC Name (2s)-1-(tert-butylamino)-3-(2-cyclopentylphenoxy)propan-2-ol
Molecular Mass 291.428 g·mol−1
Heat of Formation -412.7 ± 16.7 kJ·mol−1
Dipole Moment 0.77 ± 1.08 D
Volume 396.09 Å 3
Surface Area 322.54 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy 0.25 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-penbutolol
  • (2s)-1-(tert-butylamino)-3-(2-cyclopentylphenoxy)propan-2-ol
  • 1-(tert-butylamino)-3-(o-cyclopentylphenoxy)propan-2-ol
  • 2-propanol, 1-(2-cyclopentylphenoxy)-3-((1,1-dimethylethyl)amino)-
  • 2-propanol, 1-(2-cyclopentylphenoxy)-3-((1,1-dimethylethyl)amino)-, (s)-
  • hoe 893
  • l-penbutolol
  • levopenbutol
  • pdsp1_000056
  • pdsp2_000056
  • s(-)-penbutolol
InChIKey KQXKVJAGOJTNJS-HNNXBMFYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N