(1S,3R)-1,3-Bis(Hydroxymethyl)-7-Methoxy-6-Methyl-1,2,3,4-Tetrahydro-8-Isoquinolinol

Molecule SVG Image

Properties Simple | Detailed

Formula C13H19NO4
IUPAC Name (1r,3s)-1,3-bis(hydroxymethyl)-7-methoxy-6-methyl-1,2,3,4-tetrahydroisoquinolin-8-ol
Molecular Mass 253.294 g·mol−1
Heat of Formation -692.1 ± 16.7 kJ·mol−1
Dipole Moment 5.93 ± 1.08 D
Volume 303.92 Å 3
Surface Area 267.75 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy -0.49 ± eV
Point Group Symmetry C1
InChIKey YZJBKEBOMYOVHX-UWVGGRQHSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N