{(3R)-3-Amino-4-[(3-Hexylphenyl)Amino]-4-Oxobutyl}Phosphonic Acid

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Properties Simple | Detailed

Formula C16H27N2O4P
IUPAC Name [(3r)-3-amino-4-(3-hexylanilino)-4-oxo-butyl]phosphonic acid
Molecular Mass 342.370 g·mol−1
Heat of Formation -1039.9 ± 16.7 kJ·mol−1
Dipole Moment 2.91 ± 1.08 D
Volume 426.84 Å 3
Surface Area 398.4 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy -0.02 ± eV
Point Group Symmetry C1
Synonyms
  • (r)-3-amino-4-(3-hexylphenylamino)-4-oxobutylphosphonic acid
  • [(3r)-3-amino-4-[(3-hexylphenyl)amino]-4-keto-butyl]phosphonic acid
  • [(3r)-3-amino-4-[(3-hexylphenyl)amino]-4-oxo-butyl]phosphonic acid
  • [(3r)-3-amino-4-[(3-hexylphenyl)amino]-4-oxobutyl]phosphonic acid
  • sr-01000695420-1
  • w146
  • w146_02-01
InChIKey FWJRVGZWNDOOFH-OAHLLOKOSA-N
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