(2R,3S)-1,4-Bis(4-Hydroxy-3-Methoxyphenyl)-2,3-Dimethyl-1-Butanone

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Properties Simple | Detailed

Formula C20H24O5
IUPAC Name (2r,3s)-1,4-bis(4-hydroxy-3-methoxy-phenyl)-2,3-dimethyl-butan-1-one
Molecular Mass 344.402 g·mol−1
Heat of Formation -757.5 ± 16.7 kJ·mol−1
Dipole Moment 2.35 ± 1.08 D
Volume 423.74 Å 3
Surface Area 333.01 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -0.53 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s)-1,4-bis(4-hydroxy-3-methoxy-phenyl)-2,3-dimethyl-butan-1-one
  • (2r,3s)-1,4-bis(4-hydroxy-3-methoxyphenyl)-2,3-dimethylbutan-1-one
  • (r*,s*)-1,4-bis(4-hydroxy-3-methoxyphenyl)-2,3-dimethyl-1-butanone
  • 1-butanone, 1,4-bis(4-hydroxy-3-methoxyphenyl)-2,3-dimethyl-, (r*,s*)-
  • cinnamophilin
CAS Number(s)
  • 154677-96-0
InChIKey FPJCOLPRFZWPHM-QWHCGFSZSA-N
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