4,4'-[(3E)-3-Hexene-3,4-Diyl]Bis(2,6-Difluorophenol)

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Properties Simple | Detailed

Formula C18H16F4O2
IUPAC Name 4-[(e)-2-(3,5-difluoro-4-hydroxy-phenyl)-1-ethyl-but-1-enyl]-2,6-difluoro-phenol
Molecular Mass 340.312 g·mol−1
Heat of Formation -989.6 ± 16.7 kJ·mol−1
Dipole Moment 2.60 ± 1.08 D
Volume 380.65 Å 3
Surface Area 325.61 Å 2
HOMO Energy -9.49 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry C2
Synonyms
  • 3',5',3'',5''-tetrafluoro-diethylstilbestrol
  • 3,5,3',5'-tetrafluorodiethylstilbestrol
  • 4,4'-stilbenediol, alpha,alpha'-diethyl-3,3',5,5'-tetrafluoro-, (e)-
  • 4-[(e)-2-(3,5-difluoro-4-hydroxy-phenyl)-1-ethyl-but-1-enyl]-2,6-difluoro-phenol
  • 4-[(e)-2-(3,5-difluoro-4-hydroxyphenyl)-1-ethylbut-1-enyl]-2,6-difluorophenol
  • 4-[(e)-4-(3,5-difluoro-4-hydroxy-phenyl)hex-3-en-3-yl]-2,6-difluoro-phenol
  • 4-[(e)-4-(3,5-difluoro-4-hydroxyphenyl)hex-3-en-3-yl]-2,6-difluorophenol
  • e-3',5',3'',5''-tetrafluorodiethylstilbestrol
  • phenol, 4,4'-(1,2-diethyl-1,2-ethenediyl)bis(2,6-difluoro-, (e)-
  • tetrafluorodiethylstilbestrol
  • trans-alpha,alpha'-diethyl-3,3',5,5'-tetrafluoro-4,4'-stilbenediol
CAS Number(s)
  • 71292-84-7
InChIKey BNFMWBAVRSCLJQ-VAWYXSNFSA-N
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