(2R,3S)-2-(4-Hydroxy-3-Methoxyphenyl)-3-(Hydroxymethyl)-7-Methoxy-2,3-Dihydro-1-Benzofuran-5-Carbaldehyde

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Properties Simple | Detailed

Formula C18H18O6
IUPAC Name (2r,3s)-2-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydrobenzofuran-5-carbaldehyde
Molecular Mass 330.332 g·mol−1
Heat of Formation -768.3 ± 16.7 kJ·mol−1
Dipole Moment 2.57 ± 1.08 D
Volume 382.81 Å 3
Surface Area 328.73 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy 2.27 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s)-2-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-carbaldehyde
  • (2r,3s)-2-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydrobenzofuran-5-carbaldehyde
  • (2r,3s)-2-(4-hydroxy-3-methoxy-phenyl)-7-methoxy-3-methylol-2,3-dihydrobenzofuran-5-carbaldehyde
  • (2r,3s)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydrobenzofuran-5-carboxaldehyde
InChIKey FHRVWMUANLCTEE-DYVFJYSZSA-N
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