Ourateacatechin

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Properties Simple | Detailed

Formula C16H16O7
IUPAC Name (2r,3r)-2-(3,5-dihydroxy-4-methoxy-phenyl)chromane-3,5,7-triol
Molecular Mass 320.294 g·mol−1
Heat of Formation -1063.0 ± 16.7 kJ·mol−1
Dipole Moment 2.69 ± 1.08 D
Volume 348.21 Å 3
Surface Area 314.02 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -0.03 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r)-2-(3,5-dihydroxy-4-methoxy-phenyl)chroman-3,5,7-triol
CAS Number(s)
  • 17291-05-3
InChIKey ITDYPNOEEHONAH-UKRRQHHQSA-N
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