(2R,3R)-2-(3,4-Dimethoxyphenyl)-7-Methoxy-3-Methyl-5-[(1E)-1-Propen-1-Yl]-2,3-Dihydro-1-Benzofuran

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Properties Simple | Detailed

Formula C21H24O4
IUPAC Name (2r,3r)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-5-[(e)-prop-1-enyl]-2,3-dihydrobenzofuran
Molecular Mass 340.413 g·mol−1
Heat of Formation -412.2 ± 16.7 kJ·mol−1
Dipole Moment 4.31 ± 1.08 D
Volume 424.58 Å 3
Surface Area 384.24 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-5-[(e)-prop-1-enyl]-2,3-dihydro-1-benzofuran
  • (2r,3r)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-5-[(e)-prop-1-enyl]-2,3-dihydrobenzofuran
  • benzofuran, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-7-methoxy-3-methyl-5-(1-propenyl)-, (2r-(2alpha,3beta,5(e)))-
CAS Number(s)
  • 41744-39-2
InChIKey ITFKWUHXYCXXFF-XSOBDOKWSA-N
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