(11R,14R)-17-Amino-14-Hydroxy-14-Oxido-9,13,15-Trioxa-14Lambda~5~-Phosphaheptadecan-11-Yl Hydrogen (R)-Heptylphosphonate

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Properties Simple | Detailed

Formula C20H45NO8P2
IUPAC Name [(1r)-1-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-2-octoxy-ethoxy]-heptyl-phosphinic acid
Molecular Mass 489.521 g·mol−1
Heat of Formation -2287.0 ± 16.7 kJ·mol−1
Dipole Moment 2.78 ± 1.08 D
Volume 621.17 Å 3
Surface Area 535.69 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy -0.76 ± eV
Point Group Symmetry C1
Synonyms
  • 1-o-octyl-2-heptylphosphonylglycero-3-phosphoethanolamine
  • [(1r)-1-[(2-aminoethoxy-hydroxy-phosphoryl)oxymethyl]-2-octoxy-ethoxy]-heptyl-phosphinic acid
  • [(1r)-1-[(2-aminoethoxy-hydroxyphosphoryl)oxymethyl]-2-octoxyethoxy]-heptylphosphinic acid
  • [(2r)-1-(2-aminoethoxy-hydroxy-phosphoryl)oxy-3-octoxy-propan-2-yl]oxy-heptyl-phosphinic acid
  • [(2r)-1-(2-aminoethoxy-hydroxyphosphoryl)oxy-3-octoxypropan-2-yl]oxy-heptylphosphinic acid
  • dic(8)(2ph)pe
  • l-1-o-octyl-2-heptylphosphonyl-sn-glycero-3-phosphoethanolamine
  • phosphoric acid, mono(2-aminoethyl) mono(2-((heptylhydroxyphosphinyl)oxy)-3-(octyloxy)propyl) ester, (r)-
CAS Number(s)
  • 120411-63-4
InChIKey RCCNUBYROFOKAU-HXUWFJFHSA-N
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