1-[3,5-Bis(2-Methoxyethoxy)Phenyl]-6,7-Dimethoxy-3-Methylisoquinoline

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Properties Simple | Detailed

Formula C24H29NO6
IUPAC Name 1-[3,5-bis(2-methoxyethoxy)phenyl]-6,7-dimethoxy-3-methyl-isoquinoline
Molecular Mass 427.490 g·mol−1
Heat of Formation -716.9 ± 16.7 kJ·mol−1
Dipole Moment 2.49 ± 1.08 D
Volume 516.53 Å 3
Surface Area 472.45 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(3,5-bis(2-methoxyethoxy)phenyl)-6,7-dimethoxy-3-methylisoquinoline
  • 6,7-dimethoxy-3-methyl-1-(3',5'-bis(methoxyethoxy)phenyl)isoquinoline
  • isoquinoline, 1-(3,5-bis(2-methoxyethoxy)phenyl)-6,7-dimethoxy-3-methyl-
  • sdz mns 949
CAS Number(s)
  • 125175-65-7
InChIKey MJAIGHGDMDYBHJ-UHFFFAOYSA-N
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