Hexylphosphonic Acid (S)-2-Methyl-3-Phenylpropyl Ester

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Properties Simple | Detailed

Formula C16H27O3P
IUPAC Name hexyl-[(2s)-2-methyl-3-phenyl-propoxy]phosphinic acid
Molecular Mass 298.358 g·mol−1
Heat of Formation -882.3 ± 16.7 kJ·mol−1
Dipole Moment 3.79 ± 1.08 D
Volume 398.78 Å 3
Surface Area 345.57 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy 0.10 ± eV
Point Group Symmetry C1
Synonyms
  • 2hs
  • hexyl-dihydroxy-[(2s)-2-methyl-3-phenyl-propoxy]phosphanium
  • hexyl-dihydroxy-[(2s)-2-methyl-3-phenyl-propoxy]phosphonium
  • hexyl-dihydroxy-[(2s)-2-methyl-3-phenylpropoxy]phosphanium
  • hexyl-dihydroxy-[(2s)-2-methyl-3-phenylpropoxy]phosphonium
InChIKey MMTDYBZZRYOMFD-HNNXBMFYSA-N
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