(1R,3S)-5-(5-Hydroxy-4-Methoxy-2-Methyl-1-Naphthyl)-8-Methoxy-1,2,3-Trimethyl-1,2,3,4-Tetrahydro-6-Isoquinolinol

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Properties Simple | Detailed

Formula C25H29NO4
IUPAC Name (1r,2r,3s)-5-(5-hydroxy-4-methoxy-2-methyl-1-naphthyl)-8-methoxy-1,2,3-trimethyl-3,4-dihydro-1h-isoquinolin-6-ol
Molecular Mass 407.502 g·mol−1
Heat of Formation -546.0 ± 16.7 kJ·mol−1
Dipole Moment 2.83 ± 1.08 D
Volume 500.9 Å 3
Surface Area 394.9 Å 2
HOMO Energy -8.45 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,3s)-5-(5-hydroxy-4-methoxy-2-methyl-1-naphthyl)-8-methoxy-1,2,3-trimethyl-3,4-dihydro-1h-isoquinolin-6-ol
  • (1r,3s)-5-(5-hydroxy-4-methoxy-2-methyl-naphthalen-1-yl)-8-methoxy-1,2,3-trimethyl-3,4-dihydro-1h-isoquinolin-6-ol
  • (1r,3s)-5-(5-hydroxy-4-methoxy-2-methylnaphthalen-1-yl)-8-methoxy-1,2,3-trimethyl-3,4-dihydro-1h-isoquinolin-6-ol
InChIKey RYURKGJPUKJSGC-LSDHHAIUSA-N
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