1,1'-[(2S,3S)-2,3-Bis(Methoxymethyl)-1,4-Butanediyl]Bis(3,4-Dimethoxybenzene)

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Properties Simple | Detailed

Formula C24H34O6
IUPAC Name 4-[(2s,3s)-3-[(3,4-dimethoxyphenyl)methyl]-4-methoxy-2-(methoxymethyl)butyl]-1,2-dimethoxy-benzene
Molecular Mass 418.523 g·mol−1
Heat of Formation -850.9 ± 16.7 kJ·mol−1
Dipole Moment 1.52 ± 1.08 D
Volume 535.1 Å 3
Surface Area 454.36 Å 2
HOMO Energy -8.25 ± 0.55 eV
LUMO Energy 0.36 ± eV
Point Group Symmetry C2
Synonyms
  • 4-[(2s,3s)-3-(3,4-dimethoxybenzyl)-4-methoxy-2-(methoxymethyl)butyl]-1,2-dimethoxy-benzene
  • 4-[(2s,3s)-3-[(3,4-dimethoxyphenyl)methyl]-4-methoxy-2-(methoxymethyl)butyl]-1,2-dimethoxy-benzene
  • 4-[(2s,3s)-3-[(3,4-dimethoxyphenyl)methyl]-4-methoxy-2-(methoxymethyl)butyl]-1,2-dimethoxybenzene
  • phyllanthin
CAS Number(s)
  • 10351-88-9
InChIKey KFLQGJQSLUYUBF-WOJBJXKFSA-N
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