(1S)-7-Hydroxy-1-(3-Hydroxy-4-Methoxybenzyl)-6-Methoxy-2,2-Dimethyl-1,2,3,4-Tetrahydroisoquinolinium

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Properties Simple | Detailed

Formula C20H27NO4
IUPAC Name (1s)-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2,2-dimethyl-3,4-dihydro-1h-isoquinolin-2-ium-7-ol
Molecular Mass 345.433 g·mol−1
Heat of Formation -469.6 ± 16.7 kJ·mol−1
Dipole Moment 3.91 ± 1.08 D
Volume 432.15 Å 3
Surface Area 371.06 Å 2
Point Group Symmetry C1
Synonyms
  • (1s)-1-(3-hydroxy-4-methoxy-benzyl)-6-methoxy-2,2-dimethyl-3,4-dihydro-1h-isoquinolin-2-ium-7-ol
  • (1s)-1-[(3-hydroxy-4-methoxy-phenyl)methyl]-6-methoxy-2,2-dimethyl-3,4-dihydro-1h-isoquinolin-2-ium-7-ol
  • isoquinolinium, 1,2,3,4-tetrahydro-7-hydroxy-1-((3-hydroxy-4-methoxyphenyl)methyl)-6-methoxy-2,2-dimethyl-, (s)-
  • tembetarine
CAS Number(s)
  • 18446-73-6
InChIKey ABSDACFLIMOXJY-INIZCTEOSA-O
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