4-[(1R,2S,3S)-2,3-Bis(Hydroxymethyl)-6,7-Dimethoxy-1,2,3,4-Tetrahydro-1-Naphthalenyl]-2-Methoxyphenol

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Properties Simple | Detailed

Formula C21H26O6
IUPAC Name 4-[(1r,2s,3s)-2,3-bis(hydroxymethyl)-6,7-dimethoxy-tetralin-1-yl]-2-methoxy-phenol
Molecular Mass 374.428 g·mol−1
Heat of Formation -896.9 ± 16.7 kJ·mol−1
Dipole Moment 2.19 ± 1.08 D
Volume 450.2 Å 3
Surface Area 369.69 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy -0.03 ± eV
Point Group Symmetry C1
Synonyms
  • 2,3-naphthalenedimethanol, 1,2,3,4-tetrahydro-1-(4-hydroxy-3-methoxyphenyl)-6,7-dimethoxy-, (1r,2s,3s)-
  • 4-(2,3-bis-hydroxymethyl-6,7-dimethoxy-1,2,3,4-tetrahydro-napthalene-1-yl)-2-methoxy-phenol
  • 4-[(1r,2s,3s)-2,3-bis(hydroxymethyl)-6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2-methoxy-phenol
  • 4-[(1r,2s,3s)-2,3-bis(hydroxymethyl)-6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2-methoxyphenol
  • 4-[(1r,2s,3s)-2,3-bis(hydroxymethyl)-6,7-dimethoxy-1-tetralinyl]-2-methoxyphenol
  • 4-[(1r,2s,3s)-2,3-bis(hydroxymethyl)-6,7-dimethoxy-tetralin-1-yl]-2-methoxy-phenol
  • 4-[(1r,2s,3s)-6,7-dimethoxy-2,3-dimethylol-tetralin-1-yl]-2-methoxy-phenol
  • 9,4'9'-trihydroxy 4,5,3'-timethoxy aryltetralin lignan
  • rel-4-[(1r,2s,3s)-2,3-bis(hydroxymethyl)-6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2-methoxyphenol
  • scaphopetalone
InChIKey PDWZFAROGANMAJ-IUSZMWJPSA-N
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