Di-Hydrodehydrodiconiferyl Alcohol

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Properties Simple | Detailed

Formula C20H24O6
IUPAC Name 4-[(2r,3s)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydrobenzofuran-2-yl]-2-methoxy-phenol
Molecular Mass 360.401 g·mol−1
Heat of Formation -878.1 ± 16.7 kJ·mol−1
Dipole Moment 0.84 ± 1.08 D
Volume 432.37 Å 3
Surface Area 377.59 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-(7r,8s)-dihydrodehydrodiconiferyl alcohol
  • (-)-5-benzofuranpropanol, 2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-, (2r,3s)-
  • 4-[(2r,3s)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxy-phenol
  • 4-[(2r,3s)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenol
  • 4-[(2r,3s)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydrobenzofuran-2-yl]-2-methoxy-phenol
  • 4-[(2r,3s)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydrobenzofuran-2-yl]-2-methoxyphenol
  • 4-[(2r,3s)-5-(3-hydroxypropyl)-7-methoxy-3-methylol-2,3-dihydrobenzofuran-2-yl]-2-methoxy-phenol
InChIKey SBLZVJIHPWRSQQ-BEFAXECRSA-N
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