3-[(1R)-1-({(2S)-3-[(Cyclohexylmethyl)(Hydroxy)Phosphoryl]-2-Hydroxypropyl}Amino)Ethyl]Benzoic Acid

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Formula C19H30NO5P
IUPAC Name 3-[(1s)-1-[[(2r)-3-[cyclohexylmethyl(hydroxy)phosphoryl]-2-hydroxy-propyl]amino]ethyl]benzoic acid
Molecular Mass 383.419 g·mol−1
Heat of Formation -1172.2 ± 16.7 kJ·mol−1
Dipole Moment 3.85 ± 1.08 D
Volume 466.43 Å 3
Surface Area 355.44 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy 2.65 ± eV
Point Group Symmetry C1
InChIKey JCFULPDIJOVUHP-KBXCAEBGSA-N
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