Citral B

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Properties Simple | Detailed

Formula C10H16O
IUPAC Name (2z)-3,7-dimethylocta-2,6-dienal
Molecular Mass 152.233 g·mol−1
Heat of Formation -174.0 ± 16.7 kJ·mol−1
Dipole Moment 4.29 ± 1.08 D
Volume 224.57 Å 3
Surface Area 215.66 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy 2.84 ± eV
Point Group Symmetry C1
Synonyms
  • (2z)-3,7-dimethylocta-2,6-dienal
  • (z)-3,7-dimethylocta-2,6-dienal
  • (z)-citral
  • (z)-neral
  • 2,6-octadienal, 3,7-dimethyl-, (2z)-
  • 2,6-octadienal, 3,7-dimethyl-, (z)-
  • bb_nc-0163
  • beta-citral
  • cis-3,7-dimethyl-2,6-octadienal
  • cis-citral
  • lmpr01020054
  • neral
  • neroli aldehyde
CAS Number(s)
  • 106-26-3
InChIKey WTEVQBCEXWBHNA-YFHOEESVSA-N
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Elements H C O