(2Z,4Z,6Z,8Z)-9-[3-(3H-Diaziren-3-Yl)Phenyl]-3,7-Dimethyl-2,4,6,8-Nonatetraenal

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Properties Simple | Detailed

Formula C18H18N2O
IUPAC Name (2z,4z,6z,8z)-9-[3-(3h-diazirin-3-yl)phenyl]-3,7-dimethyl-nona-2,4,6,8-tetraenal
Molecular Mass 278.348 g·mol−1
Heat of Formation 524.8 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 367.59 Å 3
Surface Area 321.38 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy -0.94 ± eV
Point Group Symmetry C1
Synonyms
  • (2z,4z,6z,8z)-9-[3-(3h-1,2-diazirin-3-yl)phenyl]-3,7-dimethyl-nona-2,4,6,8-tetraenal
  • (2z,4z,6z,8z)-9-[3-(3h-diazirin-3-yl)phenyl]-3,7-dimethyl-nona-2,4,6,8-tetraenal
  • (2z,4z,6z,8z)-9-[3-(3h-diazirin-3-yl)phenyl]-3,7-dimethylnona-2,4,6,8-tetraenal
  • 2,4,6,8-nonatetraenal, 9-(3-(3h-diazirin-3-yl)phenyl)-3,7-dimethyl-, (all-e)-
  • 3-diazirinophenylretinal
  • m-diazirinophenylretinaldehyde
  • meta-diazirinophenylretinal
CAS Number(s)
  • 83374-72-5
InChIKey RHFWXGWGGQTUSQ-ZEUUTDFKSA-N
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