5-[(Z)-2-(3-Hydroxy-4-Methoxyphenyl)Vinyl]-2,3-Dimethoxyphenol

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Properties Simple | Detailed

Formula C17H18O5
IUPAC Name 5-[(z)-2-(3-hydroxy-4-methoxy-phenyl)vinyl]-2,3-dimethoxy-phenol
Molecular Mass 302.322 g·mol−1
Heat of Formation -588.0 ± 16.7 kJ·mol−1
Dipole Moment 1.57 ± 1.08 D
Volume 367.72 Å 3
Surface Area 310.28 Å 2
HOMO Energy -8.36 ± 0.55 eV
LUMO Energy -0.10 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[(z)-2-(3-hydroxy-4-methoxy-phenyl)ethenyl]-2,3-dimethoxy-phenol
  • 5-[(z)-2-(3-hydroxy-4-methoxy-phenyl)vinyl]-2,3-dimethoxy-phenol
  • 5-[(z)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]-2,3-dimethoxyphenol
  • combretastatin a3
CAS Number(s)
  • 111394-45-7
InChIKey XLGIRKMVTSMTDU-PLNGDYQASA-N
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