Xanthaline

Molecule SVG Image

Properties Simple | Detailed

Formula C20H19NO5
IUPAC Name (6,7-dimethoxy-1-isoquinolyl)-(3,4-dimethoxyphenyl)methanone
Molecular Mass 353.369 g·mol−1
Heat of Formation -440.8 ± 16.7 kJ·mol−1
Dipole Moment 5.06 ± 1.08 D
Volume 416.02 Å 3
Surface Area 360.21 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
Synonyms
  • (6,7-dimethoxy-1-isoquinolyl) (3,4-dimethoxyphenyl) ketone
  • (6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methanone
  • (6,7-dimethoxyisoquinolin-1-yl)-(3,4-dimethoxyphenyl)methanone
  • 6,7-dimethoxy-1-veratroylisoquinoline
  • ketone, 6,7-dimethoxy-1-isoquinolyl 3,4-dimethoxyphenyl
  • ketone, 6,7-dimethoxy-1-isoquinolyl 3,4-dimethoxyphenyl (8ci)
  • methanone, (6,7-dimethoxy-1-isoquinolinyl)(3,4-dimethoxyphenyl)-
  • methanone, (6,7-dimethoxy-1-isoquinolinyl)(3,4-dimethoxyphenyl)- (9ci)
  • papaveraldin
  • papaveraldine
CAS Number(s)
  • 522-57-6
InChIKey QJTBIAMBPGGIGI-UHFFFAOYSA-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