{(1E)-4-[(5-Fluoro-2-Hydroxyphenyl)Sulfanyl]-1-Buten-1-Yl}Phosphonic Acid

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Properties Simple | Detailed

Formula C10H12FO4PS
IUPAC Name [(e)-4-(5-fluoro-2-hydroxy-phenyl)sulfanylbut-1-enyl]phosphonic acid
Molecular Mass 278.237 g·mol−1
Heat of Formation -1038.0 ± 16.7 kJ·mol−1
Dipole Moment 2.55 ± 1.08 D
Volume 300.54 Å 3
Surface Area 287.29 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy -1.28 ± eV
Point Group Symmetry C1
Synonyms
  • 4-(5-fluoro-2-hydroxy-phenyl)sulfanylbut-1-enylphosphonic acid
  • 4-(5-fluoro-2-hydroxyphenyl)sulfanylbut-1-enylphosphonic acid
  • 4-[(5-fluoro-2-hydroxy-phenyl)thio]but-1-enylphosphonic acid
  • 4-[(5-fluoro-2-hydroxyphenyl)thio]but-1-enylphosphonic acid
  • [(e)-4-(5-fluoro-2-hydroxy-phenyl)sulfanylbut-1-enyl]phosphonic acid
  • [(e)-4-(5-fluoro-2-hydroxyphenyl)sulfanylbut-1-enyl]phosphonic acid
  • [(e)-4-[(5-fluoro-2-hydroxy-phenyl)thio]but-1-enyl]phosphonic acid
  • [(e)-4-[(5-fluoro-2-hydroxyphenyl)thio]but-1-enyl]phosphonic acid
InChIKey UXOYJQMPYTYCMG-ORCRQEGFSA-N
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Elements C F H O P S