(E)-2-(3,4-Dihydroxyphenyl)Vinyl Hydrogen Sulfate

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Properties Simple | Detailed

Formula C8H8O6S
IUPAC Name [(e)-2-(3,4-dihydroxyphenyl)vinyl] hydrogen sulfate
Molecular Mass 232.211 g·mol−1
Heat of Formation -898.7 ± 16.7 kJ·mol−1
Dipole Moment 3.04 ± 1.08 D
Volume 234.47 Å 3
Surface Area 233.89 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(3',4'-dihydroxyphenyl)ethylene sulfate
  • [(e)-2-(3,4-dihydroxyphenyl)ethenyl] hydrogen sulfate
  • [(e)-2-(3,4-dihydroxyphenyl)vinyl] hydrogen sulfate
CAS Number(s)
  • 158080-67-2
InChIKey BGUVCXKOVJXTPG-ONEGZZNKSA-N
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