(1R,2S,8Z,10S)-4,8,11,11-Tetramethylbicyclo[8.1.0]Undeca-4,8-Dien-2-Yl (2E)-3-Phenylacrylate

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Properties Simple | Detailed

Formula C24H30O2
IUPAC Name [(1r,2s,4z,8z,10s)-4,8,11,11-tetramethyl-2-bicyclo[8.1.0]undeca-4,8-dienyl] (e)-3-phenylprop-2-enoate
Molecular Mass 350.494 g·mol−1
Heat of Formation -191.6 ± 16.7 kJ·mol−1
Dipole Moment 1.64 ± 1.08 D
Volume 464.03 Å 3
Surface Area 383.87 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy -0.67 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-3-phenylacrylic acid [(1r,2s,4z,8z,10s)-4,8,11,11-tetramethyl-2-bicyclo[8.1.0]undeca-4,8-dienyl] ester
  • (e)-3-phenylprop-2-enoic acid [(1r,2s,4z,8z,10s)-4,8,11,11-tetramethyl-2-bicyclo[8.1.0]undeca-4,8-dienyl] ester
  • 2-propenoic acid, 3-phenyl-, 4,8,11,11-tetramethylbicyclo(8.1.0)undeca-4,8-dien-2-yl ester
  • [(1r,2s,4z,8z,10s)-4,8,11,11-tetramethyl-2-bicyclo[8.1.0]undeca-4,8-dienyl] (e)-3-phenylprop-2-enoate
  • guayulin a
CAS Number(s)
  • 31685-97-9
InChIKey JYEVPOCBZDNGDL-ISCJZRRASA-N
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