Hernanol

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Properties Simple | Detailed

Formula C22H26O7
IUPAC Name (3r,4r)-4-[(4-hydroxy-3-methoxy-phenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]tetrahydrofuran-2-one
Molecular Mass 402.438 g·mol−1
Heat of Formation -1050.0 ± 16.7 kJ·mol−1
Dipole Moment 4.61 ± 1.08 D
Volume 477.58 Å 3
Surface Area 353.91 Å 2
HOMO Energy -8.87 ± 0.55 eV
LUMO Energy -0.02 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4r)-4-(4-hydroxy-3-methoxy-benzyl)-3-(3,4,5-trimethoxybenzyl)tetrahydrofuran-2-one
  • (3r,4r)-4-(4-hydroxy-3-methoxybenzyl)-3-(3,4,5-trimethoxybenzyl)dihydrofuran-2(3h)-one
  • (3r,4r)-4-[(4-hydroxy-3-methoxy-phenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one
  • (3r,4r)-4-[(4-hydroxy-3-methoxy-phenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]tetrahydrofuran-2-one
  • (3r,4r)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]-2-tetrahydrofuranone
  • (3r,4r)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one
  • 2(3h)-furanone, dihydro-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]-, (3r,4r)-
  • 4-(4-hydroxy-3-methoxy-benzyl)-3-(3,4,5-trimethoxy-benzyl)-dihydro-furan-2-one
InChIKey NQDCTUUMEFECTD-JKSUJKDBSA-N
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