4-Oxoretinol

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Properties Simple | Detailed

Formula C20H28O2
IUPAC Name 3-[(1e,3e,5e,7e)-9-hydroxy-3,7-dimethyl-nona-1,3,5,7-tetraenyl]-2,4,4-trimethyl-cyclohex-2-en-1-one
Molecular Mass 300.435 g·mol−1
Heat of Formation -277.8 ± 16.7 kJ·mol−1
Dipole Moment 5.72 ± 1.08 D
Volume 411.09 Å 3
Surface Area 368.63 Å 2
HOMO Energy -8.55 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(9-hydroxy-3,7-dimethyl-nona-1,3,5,7-tetraenyl)-2,4,4-trimethyl-cyclohex-2-en-1-one
  • 3-(9-hydroxy-3,7-dimethylnona-1,3,5,7-tetraenyl)-2,4,4-trimethyl-1-cyclohex-2-enone
  • 3-(9-hydroxy-3,7-dimethylnona-1,3,5,7-tetraenyl)-2,4,4-trimethylcyclohex-2-en-1-one
  • 3-[(1e,3e,5e,7e)-9-hydroxy-3,7-dimethyl-nona-1,3,5,7-tetraenyl]-2,4,4-trimethyl-cyclohex-2-en-1-one
  • 3-[(1e,3e,5e,7e)-9-hydroxy-3,7-dimethylnona-1,3,5,7-tetraenyl]-2,4,4-trimethyl-1-cyclohex-2-enone
  • 3-[(1e,3e,5e,7e)-9-hydroxy-3,7-dimethylnona-1,3,5,7-tetraenyl]-2,4,4-trimethylcyclohex-2-en-1-one
  • 4-ketoretinol
  • oxr
  • retinol, 4-oxo-
CAS Number(s)
  • 62702-55-0
InChIKey PLIUCYCUYQIBDZ-RMWYGNQTSA-N
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