4-[(S)-Amino(Carboxy)Methyl]-2-Hydroxybenzoic Acid

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Properties Simple | Detailed

Formula C9H9NO5
IUPAC Name 4-[(s)-amino(carboxy)methyl]-2-hydroxy-benzoic acid
Molecular Mass 211.171 g·mol−1
Heat of Formation -850.0 ± 16.7 kJ·mol−1
Dipole Moment 2.57 ± 1.08 D
Volume 228.43 Å 3
Surface Area 219.08 Å 2
HOMO Energy -9.75 ± 0.55 eV
LUMO Energy -1.12 ± eV
Point Group Symmetry C1
Synonyms
  • (s)-4c3hpg
  • 4-[(1s)-1-amino-2-hydroxy-2-keto-ethyl]-2-hydroxy-benzoic acid
  • 4-[(1s)-1-amino-2-hydroxy-2-oxo-ethyl]-2-hydroxy-benzoic acid
  • 4-[(1s)-1-amino-2-hydroxy-2-oxoethyl]-2-hydroxybenzoic acid
  • pdsp1_001316
  • pdsp2_001300
  • tocris-0320
InChIKey GXZSAQLJWLCLOX-ZETCQYMHSA-N
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