(2S)-2-Amino-3-[2'-Chloro-5-(Phosphonomethyl)-3-Biphenylyl]Propanoic Acid

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Properties Simple | Detailed

Formula C16H17ClNO5P
IUPAC Name (2s)-2-amino-3-[3-(2-chlorophenyl)-5-(phosphonomethyl)phenyl]propanoic acid
Molecular Mass 369.737 g·mol−1
Heat of Formation -1092.2 ± 16.7 kJ·mol−1
Dipole Moment 4.39 ± 1.08 D
Volume 408.7 Å 3
Surface Area 344.31 Å 2
HOMO Energy -9.34 ± 0.55 eV
LUMO Energy -0.30 ± eV
Point Group Symmetry C1
Synonyms
  • (1,1'-biphenyl)-3-propanoic acid, alpha-amino-2'-chloro-5-(phosphonomethyl)-, (s)-
  • (2s)-2-amino-3-[3-(2-chlorophenyl)-5-(phosphonomethyl)phenyl]propanoic acid
  • (2s)-2-amino-3-[3-(2-chlorophenyl)-5-(phosphonomethyl)phenyl]propionic acid
  • alpha-amino-2'-chloro-5-(phosphonomethyl)(1,1'-biphenyl)-3-propanoic acid
  • biomol-nt_000193
  • bpbio1_001218
  • sdz 220-581
  • sdz-220-581
  • tocris-1250
CAS Number(s)
  • 174575-17-8
InChIKey VBRJFXSFCYEZMQ-HNNXBMFYSA-N
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Elements C Cl H O N P