Epinine

Molecule SVG Image

Properties Simple | Detailed

Formula C9H13NO2
IUPAC Name 4-[2-(methylamino)ethyl]benzene-1,2-diol
Molecular Mass 167.205 g·mol−1
Heat of Formation -296.0 ± 16.7 kJ·mol−1
Dipole Moment 3.67 ± 1.08 D
Volume 212.42 Å 3
Surface Area 211.49 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy -0.00 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2-benzenediol, 4-(2-(methylamino)ethyl)-
  • 1,2-benzenediol, 4-[2-(methylamino)ethyl]-
  • 4-(2-methylaminoethyl)benzene-1,2-diol
  • 4-(2-methylaminoethyl)pyrocatechol
  • biomol-nt_000002
  • bpbio1_001125
  • deoxyepinephrine
  • pdsp1_001130
  • pdsp2_001114
CAS Number(s)
  • 501-15-5
InChIKey NGKZFDYBISXGGS-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N