(2S,3S)-2-(3,4-Dimethoxyphenyl)-7-Methoxy-3-Methyl-2,3-Dihydro-1-Benzofuran-5-Carbaldehyde

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Properties Simple | Detailed

Formula C19H20O5
IUPAC Name (2s,3s)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-2,3-dihydrobenzofuran-5-carbaldehyde
Molecular Mass 328.359 g·mol−1
Heat of Formation -571.7 ± 16.7 kJ·mol−1
Dipole Moment 4.18 ± 1.08 D
Volume 389.3 Å 3
Surface Area 350.99 Å 2
HOMO Energy -8.58 ± 0.55 eV
LUMO Energy -0.54 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-2,3-dihydrobenzofuran-5-carbaldehyde
  • (2s,3s)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-2,3-dihydrobenzofuran-5-carboxaldehyde
  • 5-benzofurancarboxaldehyde, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-7-methoxy-3-methyl-, (2s-trans)-
  • 7s,8s-3,4,3'-trimethoxy-7'-oxo-nor-8',9'-7.o.4',8,5'-neolignan
CAS Number(s)
  • 150133-00-9
InChIKey XBEUHOWSGYZENI-VOJFVSQTSA-N
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