O~15~-Methylretinol

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Properties Simple | Detailed

Formula C21H32O
IUPAC Name 2-[(1e,3e,5e,7e)-9-methoxy-3,7-dimethyl-nona-1,3,5,7-tetraenyl]-1,3,3-trimethyl-cyclohexene
Molecular Mass 300.478 g·mol−1
Heat of Formation -131.7 ± 16.7 kJ·mol−1
Dipole Moment 2.22 ± 1.08 D
Volume 435.33 Å 3
Surface Area 385.83 Å 2
HOMO Energy -8.37 ± 0.55 eV
LUMO Energy -0.16 ± eV
Point Group Symmetry C1
Synonyms
  • (all-e)-2-(9-methoxy-3,7-dimethyl-1,3,5,7-nonatetraenyl)-1,3,3-trimethylcyclohexene
  • 2-(9-methoxy-3,7-dimethyl-1,3,5,7-nonatetraenyl)-1,3,3-trimethylcyclohexene
  • 2-[(1e,3e,5e,7e)-9-methoxy-3,7-dimethyl-nona-1,3,5,7-tetraenyl]-1,3,3-trimethyl-cyclohexene
  • 2-[(1e,3e,5e,7e)-9-methoxy-3,7-dimethylnona-1,3,5,7-tetraenyl]-1,3,3-trimethylcyclohexene
  • cyclohexene, 2-(9-methoxy-3,7-dimethyl-1,3,5,7-nonatetraenyl)-1,3,3-trimethyl-, (all-e)-
  • retinyl methyl ether
  • ro 1-5218
CAS Number(s)
  • 32450-56-9
InChIKey XWULCDOSZPRLEQ-QHLGVNSISA-N
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