4-[2-(3,5-Dimethoxyphenyl)Ethyl]-1,2-Benzenediol

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Properties Simple | Detailed

Formula C16H18O4
IUPAC Name 4-[2-(3,5-dimethoxyphenyl)ethyl]benzene-1,2-diol
Molecular Mass 274.312 g·mol−1
Heat of Formation -560.8 ± 16.7 kJ·mol−1
Dipole Moment 3.32 ± 1.08 D
Volume 336.42 Å 3
Surface Area 311.86 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.06 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2-benzenediol, 4-(2-(3,5-dimethoxyphenyl)ethyl)-
  • 4-[2-(3,5-dimethoxyphenyl)ethyl]pyrocatechol
  • combretastatin b4
CAS Number(s)
  • 116518-75-3
InChIKey PBRZRNRAYCSTKB-UHFFFAOYSA-N
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