(2R)-3-{[(1S)-1-Aminoethyl](Hydroxy)Phosphoryl}-2-Methylpropanoic Acid

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Properties Simple | Detailed

Formula C6H14NO4P
IUPAC Name (2r)-3-[[(1s)-1-aminoethyl]-hydroxy-phosphoryl]-2-methyl-propanoic acid
Molecular Mass 195.153 g·mol−1
Heat of Formation -950.7 ± 16.7 kJ·mol−1
Dipole Moment 3.17 ± 1.08 D
Volume 234.93 Å 3
Surface Area 218.63 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy 3.21 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-3-[[(1s)-1-aminoethyl]-hydroxy-phosphoryl]-2-methyl-propanoic acid
  • (2r)-3-[[(1s)-1-aminoethyl]-hydroxy-phosphoryl]-2-methyl-propionic acid
  • (2r)-3-[[(1s)-1-aminoethyl]-hydroxyphosphoryl]-2-methylpropanoic acid
InChIKey XXVGIEKADYFHOF-WHFBIAKZSA-N
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