(3S)-8-Hydroxy-3-Methyl-3,4-Dihydro-1H-Isochromen-1-One

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Properties Simple | Detailed

Formula C10H10O3
IUPAC Name (3s)-8-hydroxy-3-methyl-isochroman-1-one
Molecular Mass 178.185 g·mol−1
Heat of Formation -455.2 ± 16.7 kJ·mol−1
Dipole Moment 5.43 ± 1.08 D
Volume 204.28 Å 3
Surface Area 198.13 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy -0.63 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-8-hydroxy-3-methyl-1-isochromanone
  • (3s)-8-hydroxy-3-methyl-isochroman-1-one
  • (3s)-8-hydroxy-3-methylisochroman-1-one
InChIKey KWILGNNWGSNMPA-LURJTMIESA-N
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Elements H C O