[2-(3,4-Dihydroxyphenyl)-2-Oxoethyl](Dimethyl)Sulfonium

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Properties Simple | Detailed

Formula C10H13O3S+
IUPAC Name [2-(3,4-dihydroxyphenyl)-2-oxoethyl]-dimethylsulfanium
Molecular Mass 213.273 g·mol−1
Heat of Formation 1056.0 ± 16.7 kJ·mol−1
Dipole Moment 2.82 ± 1.08 D
Volume 211.91 Å 3
Surface Area 210.67 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy -2.47 ± eV
Point Group Symmetry Cs
Synonyms
  • (2-(3,4-dihydroxyphenyl)-2-oxoethyl)dimethylsulfonium
  • (2-(3,4-dihydroxyphenyl)-2-oxoethyl)dimethylsulfonium iodide
  • [2-(3,4-dihydroxyphenyl)-2-keto-ethyl]-dimethyl-sulfonium
  • [2-(3,4-dihydroxyphenyl)-2-oxo-ethyl]-dimethyl-sulfanium
  • [2-(3,4-dihydroxyphenyl)-2-oxo-ethyl]-dimethyl-sulfonium
  • [2-(3,4-dihydroxyphenyl)-2-oxoethyl]-dimethylsulfonium
  • dhpoe-dms
  • sulfonium, (2-(3,4-dihydroxyphenyl)-2-oxoethyl)dimethyl-
CAS Number(s)
  • 80263-70-3
InChIKey ZAMWWUKFTNAPSN-UHFFFAOYSA-O
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