3-(3,4,5-Trimethoxyphenyl)-1-Oxo-2-Propene

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Properties Simple | Detailed

Formula C12H14O4
IUPAC Name (e)-3-(3,4,5-trimethoxyphenyl)prop-2-enal
Molecular Mass 222.237 g·mol−1
Heat of Formation -419.3 ± 16.7 kJ·mol−1
Dipole Moment 3.59 ± 1.08 D
Volume 275.43 Å 3
Surface Area 261.01 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy -1.10 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-3-(3,4,5-trimethoxyphenyl)acrolein
  • (e)-3-(3,4,5-trimethoxyphenyl)prop-2-enal
  • 2-propenal, 3-(3,4,5-trimethoxyphenyl)-
  • 2-propenal, 3-(3,4,5-trimethoxyphenyl)- (9ci)
  • 3,4,5-trimethoxycinnamaldehyde
  • 3,4,5-trimethoxycinnamic aldehyde
  • 3-(3,4,5-trimethoxyphenyl)-2-propenal
  • 3-(3,4,5-trimethoxyphenyl)acrolein
  • 3-(3,4,5-trimethoxyphenyl)prop-2-enal
  • cinnamaldehyde, 3,4,5-trimethoxy-
  • pk04_181168
CAS Number(s)
  • 34346-90-2
InChIKey XDSHNNRBLSBDAP-SNAWJCMRSA-N
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