4-Methoxy-6-Methyl-5,6,7,8-Tetrahydro[1,3]Dioxolo[4,5-G]Isoquinoline

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Properties Simple | Detailed

Formula C12H15NO3
IUPAC Name (6s)-4-methoxy-6-methyl-7,8-dihydro-5h-[1,3]dioxolo[4,5-g]isoquinoline
Molecular Mass 221.252 g·mol−1
Heat of Formation -321.5 ± 16.7 kJ·mol−1
Dipole Moment 1.91 ± 1.08 D
Volume 256.07 Å 3
Surface Area 240.34 Å 2
HOMO Energy -8.55 ± 0.55 eV
LUMO Energy 0.27 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-dioxolo[4,5-g]isoquinoline, 5,6,7,8-tetrahydro-4-methoxy-6-methyl-
  • 4-methoxy-6-methyl-7,8-dihydro-5h-[1,3]dioxolo[4,5-g]isoquinoline
  • bpbio1_000562
  • sdccgmls-0066725.p001
InChIKey XXANNZJIZQTCBP-UHFFFAOYSA-N
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