Isochroman

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Properties Simple | Detailed

Formula C9H10O
IUPAC Name isochromane
Molecular Mass 134.175 g·mol−1
Heat of Formation -96.2 ± 16.7 kJ·mol−1
Dipole Moment 1.23 ± 1.08 D
Volume 167.74 Å 3
Surface Area 167.76 Å 2
HOMO Energy -9.39 ± 0.55 eV
LUMO Energy -0.11 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-2-benzopyran, 3,4-dihydro-
  • 3,4-dihydro-1h-2-benzopyran
  • 3,4-dihydro-1h-isochromene
  • sb 01207
CAS Number(s)
  • 493-05-0
InChIKey HEBMCVBCEDMUOF-UHFFFAOYSA-N
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