(2R,3S)-2-(4-Hydroxyphenyl)-3,5,7-Chromanetriol

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Properties Simple | Detailed

Formula C15H14O5
IUPAC Name (2r,3s)-2-(4-hydroxyphenyl)chromane-3,5,7-triol
Molecular Mass 274.269 g·mol−1
Heat of Formation -741.8 ± 16.7 kJ·mol−1
Dipole Moment 1.62 ± 1.08 D
Volume 306.8 Å 3
Surface Area 279.54 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy 0.13 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s)-2-(4-hydroxyphenyl)chroman-3,5,7-triol
  • 3,5,7,4'-tetrahydroxyflavan
  • afzelechin
CAS Number(s)
  • 2545-00-8
InChIKey RSYUFYQTACJFML-DZGCQCFKSA-N
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