2-[(2-Hydroxyethyl)Sulfanyl]-1,4-Naphthoquinone

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Properties Simple | Detailed

Formula C12H10O3S
IUPAC Name 2-(2-hydroxyethylsulfanyl)naphthalene-1,4-dione
Molecular Mass 234.271 g·mol−1
Heat of Formation -270.9 ± 16.7 kJ·mol−1
Dipole Moment 1.28 ± 1.08 D
Volume 259.88 Å 3
Surface Area 246.79 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy 1.20 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,4-naphthalenedione, 2-[(2-hydroxyethyl)thio]-
  • 2-(2-hydroxyethylthio)-1,4-naphthoquinone
  • 2-(2-hydroxyethylthio)naphthalene-1,4-dione
CAS Number(s)
  • 83293-77-0
InChIKey IBLOZMPODBITIK-UHFFFAOYSA-N
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Elements H C S O