1-(2-Bromo-4,5-Dimethoxybenzyl)-6-Methoxy-2-Methyl-1,2,3,4-Tetrahydro-7-Isoquinolinol

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Properties Simple | Detailed

Formula C20H24BrNO4
IUPAC Name (1s,2s)-1-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1h-isoquinolin-7-ol
Molecular Mass 422.313 g·mol−1
Heat of Formation -477.2 ± 16.7 kJ·mol−1
Dipole Moment 4.98 ± 1.08 D
Volume 447.79 Å 3
Surface Area 376.1 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -0.05 ± eV
Point Group Symmetry C1
InChIKey YVBUTIYRCMQJHW-INIZCTEOSA-N
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Elements H C O Br N