2,3-Bis(Heptanoyloxy)Propyl 2-(Trimethylammonio)Ethyl Phosphate

Molecule SVG Image

Properties Simple | Detailed

Formula C22H44NO8P
IUPAC Name 2-[[(2r)-2,3-di(heptanoyloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
Molecular Mass 481.560 g·mol−1
Heat of Formation 1397.2 ± 16.7 kJ·mol−1
Dipole Moment 8.09 ± 1.08 D
Volume 351.15 Å 3
Surface Area 287.78 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy -2.66 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[[(2r)-2,3-bis(1-oxoheptoxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium
  • 2-[[(2r)-2,3-di(heptanoyloxy)propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium
  • 2-[[(2r)-2,3-di(heptanoyloxy)propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-azanium
  • 2-[[(2r)-2,3-dienanthyloxypropoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium
InChIKey RBFSPQDASPEAID-HXUWFJFHSA-O
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C O N