(3S,4S)-7-(Hydroxymethyl)-3,4-Dihydro-3,4-Tetraphenediol

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Properties Simple | Detailed

Formula C19H16O3
IUPAC Name (3s,4s)-7-(hydroxymethyl)-3,4-dihydrobenzo[a]anthracene-3,4-diol
Molecular Mass 292.329 g·mol−1
Heat of Formation -258.9 ± 16.7 kJ·mol−1
Dipole Moment 1.44 ± 1.08 D
Volume 333.43 Å 3
Surface Area 296.25 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy -1.47 ± eV
Point Group Symmetry C1
Synonyms
  • (3s,4s)-7-(hydroxymethyl)-3,4-dihydrobenzo[a]anthracene-3,4-diol
  • (3s,4s)-7-methylol-3,4-dihydrobenzo[a]anthracene-3,4-diol
  • 7-hydroxymethylbenz(a)anthracene-3,4-dihydrodiol
  • 7-ohmba-3,4
  • benz(a)anthracene-3,4-diol, 3,4-dihydro-7-(hydroxymethyl)-, trans-
CAS Number(s)
  • 83481-43-0
InChIKey ROEFSOMLGQWZCI-OALUTQOASA-N
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