2-Methoxy-2,4,6-Cycloheptatrien-1-One

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Properties Simple | Detailed

Formula C8H8O2
IUPAC Name 2-methoxycyclohepta-2,4,6-trien-1-one
Molecular Mass 136.148 g·mol−1
Heat of Formation -115.1 ± 16.7 kJ·mol−1
Dipole Moment 1.78 ± 1.08 D
Volume 165.75 Å 3
Surface Area 167.28 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy 2.34 ± eV
Point Group Symmetry C1
Synonyms
  • .alpha.-methoxytropone
  • 2,4,6-cycloheptatrien-1-one, 2-methoxy-
  • 2-c-methoxytropone
  • 2-methoxy-1-cyclohepta-2,4,6-trienone
  • 2-methoxycycloheptatrienone
  • 2-methoxytropolone
  • 2-methoxytropone
  • alpha-methoxytropone
  • tropolone methyl ether
CAS Number(s)
  • 2161-40-2
InChIKey IQYJSKNHDZZDGA-UHFFFAOYSA-N
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