1-(Hydroxymethyl)-6,7-Dimethoxy-2-Methyl-1,2,3,4-Tetrahydro-5-Isoquinolinol

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Properties Simple | Detailed

Formula C13H19NO4
IUPAC Name (1s)-1-(hydroxymethyl)-6,7-dimethoxy-2-methyl-3,4-dihydro-1h-isoquinolin-5-ol
Molecular Mass 253.294 g·mol−1
Heat of Formation -577.8 ± 16.7 kJ·mol−1
Dipole Moment 3.46 ± 1.08 D
Volume 302.76 Å 3
Surface Area 272.48 Å 2
HOMO Energy -8.63 ± 0.55 eV
LUMO Energy -0.09 ± eV
Point Group Symmetry C1
InChIKey CGNTUKTXUKHAEG-JTQLQIEISA-N
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