(2R,2'R,4A'S,6'R,8A'S)-4,6'-Dihydroxy-2',5',5',8A'-Tetramethyl-3',4',4A',5',6',7',8',8A'-Octahydro-2'H,3H-Spiro[1-Benzofuran-2,1'-Naphthalene]-6,7-Dicarbaldehyde

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Properties Simple | Detailed

Formula C23H30O5
IUPAC Name (2r,2'r,4'as,6'r,8'as)-2',4-dihydroxy-1',1',4'a,6'-tetramethyl-spiro[3h-benzofuran-2,5'-decalin]-6,7-dicarbaldehyde
Molecular Mass 386.481 g·mol−1
Heat of Formation -895.3 ± 16.7 kJ·mol−1
Dipole Moment 5.88 ± 1.08 D
Volume 463.32 Å 3
Surface Area 349.45 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy -0.86 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,2'r,4'as,6'r,8'as)-2',4-dihydroxy-1',1',4'a,6'-tetramethyl-spiro[3h-benzofuran-2,5'-decalin]-6,7-dicarbaldehyde
  • (2r,2'r,4'as,6'r,8'as)-2',4-dihydroxy-1',1',4'a,6'-tetramethylspiro[3h-benzofuran-2,5'-decalin]-6,7-dicarboxaldehyde
  • (3r,4as,7r,8r,8as)-3,4'-dihydroxy-4,4,7,8a-tetramethyl-spiro[2,3,4a,5,6,7-hexahydro-1h-naphthalene-8,2'-3h-1-benzofuran]-6',7'-dicarbaldehyde
  • (3r,4as,7r,8r,8as)-3,4'-dihydroxy-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1h-naphthalene-8,2'-3h-1-benzofuran]-6',7'-dicarbaldehyde
InChIKey WIGGVNIABVHHCS-QJAXDWLUSA-N
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