4-[(S)-Amino(Carboxy)Methyl]Benzoic Acid

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Properties Simple | Detailed

Formula C9H9NO4
IUPAC Name 4-[(s)-amino(carboxy)methyl]benzoic acid
Molecular Mass 195.172 g·mol−1
Heat of Formation -638.9 ± 16.7 kJ·mol−1
Dipole Moment 1.85 ± 1.08 D
Volume 220.96 Å 3
Surface Area 213.02 Å 2
HOMO Energy -10.12 ± 0.55 eV
LUMO Energy -1.31 ± eV
Point Group Symmetry C1
Synonyms
  • (s)-4cpg
  • 4-[(1s)-1-amino-2-hydroxy-2-keto-ethyl]benzoic acid
  • 4-[(1s)-1-amino-2-hydroxy-2-oxo-ethyl]benzoic acid
  • 4-[(1s)-1-amino-2-hydroxy-2-oxoethyl]benzoic acid
  • pdsp1_001432
  • pdsp2_001416
  • tocris-0323
InChIKey VTMJKPGFERYGJF-ZETCQYMHSA-N
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