(3Z,6S,7R)-3-Butylidene-6,7-Dihydroxy-4,5,6,7-Tetrahydro-2-Benzofuran-1(3H)-One

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Formula C12H16O4
IUPAC Name (3z,6s,7r)-3-butylidene-6,7-dihydroxy-4,5,6,7-tetrahydroisobenzofuran-1-one
Molecular Mass 224.253 g·mol−1
Heat of Formation -643.8 ± 16.7 kJ·mol−1
Dipole Moment 7.26 ± 1.08 D
Volume 268.95 Å 3
Surface Area 253.59 Å 2
HOMO Energy -9.36 ± 0.55 eV
LUMO Energy 2.04 ± eV
Point Group Symmetry C1
Synonyms
  • (3z,6s,7r)-3-butylidene-6,7-dihydroxy-4,5,6,7-tetrahydro-2-benzofuran-1-one
  • (3z,6s,7r)-3-butylidene-6,7-dihydroxy-4,5,6,7-tetrahydroisobenzofuran-1-one
  • senkyunolide h
InChIKey DQNGMIQSXNGHOA-RCBCECLLSA-N
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