(3As,8Bs)-7-Chloro-3A-Methyl-3A,8B-Dihydrofuro[3,4-B][1]Benzofuran-3(1H)-One

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Properties Simple | Detailed

Formula C11H9ClO3
IUPAC Name (3as,8bs)-7-chloro-3a-methyl-1,8b-dihydrofuro[3,4-b]benzofuran-3-one
Molecular Mass 224.640 g·mol−1
Heat of Formation -414.4 ± 16.7 kJ·mol−1
Dipole Moment 4.19 ± 1.08 D
Volume 238.96 Å 3
Surface Area 223.37 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry C1
Synonyms
  • (3as,8bs)-7-chloro-3a-methyl-1,8b-dihydrofuro[3,4-b][1]benzoxol-3-one
  • (3as,8bs)-7-chloro-3a-methyl-1,8b-dihydrofuro[3,4-b]benzofuran-3-one
  • 7-chloro-3a,8b-dihydro-3a-methylfuro(3,4-b)benzofuran-3(lh)-one
  • furo(3,4-b)benzofuran-3(1h)-one, 7-chloro-3a,8b-dihydro-3a-methyl-, cis-
CAS Number(s)
  • 59874-49-6
InChIKey ILTAZMXNVLCKLU-KCJUWKMLSA-N
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