Vestitol

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Properties Simple | Detailed

Formula C16H16O4
IUPAC Name (3s)-3-(2-hydroxy-4-methoxy-phenyl)chroman-7-ol
Molecular Mass 272.296 g·mol−1
Heat of Formation -543.0 ± 16.7 kJ·mol−1
Dipole Moment 4.58 ± 1.08 D
Volume 313.42 Å 3
Surface Area 286.98 Å 2
HOMO Energy -8.62 ± 0.55 eV
LUMO Energy -0.06 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-3-(2-hydroxy-4-methoxy-phenyl)chroman-7-ol
  • (3s)-3-(2-hydroxy-4-methoxyphenyl)-7-chromanol
  • (3s)-3-(2-hydroxy-4-methoxyphenyl)chroman-7-ol
CAS Number(s)
  • 20879-05-4
InChIKey XRVFNNUXNVWYTI-LLVKDONJSA-N
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DOI
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