3-Carboxy-α-Methyl-L-Phenylalanine

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Properties Simple | Detailed

Formula C11H13NO4
IUPAC Name 3-[(2s)-2-amino-2-carboxy-propyl]benzoic acid
Molecular Mass 223.225 g·mol−1
Heat of Formation -698.6 ± 16.7 kJ·mol−1
Dipole Moment 2.47 ± 1.08 D
Volume 265.61 Å 3
Surface Area 233.94 Å 2
HOMO Energy -9.91 ± 0.55 eV
LUMO Energy -0.76 ± eV
Point Group Symmetry C1
Synonyms
  • 3-[(2s)-2-amino-3-hydroxy-2-methyl-3-oxo-propyl]benzoic acid
  • 3-[(2s)-2-amino-3-hydroxy-2-methyl-3-oxopropyl]benzoic acid
  • 3-[(2s)-2-amino-3-hydroxy-3-keto-2-methyl-propyl]benzoic acid
  • alpha-methyl-3-carboxyphenylalanine
CAS Number(s)
  • 171031-50-8
InChIKey AORMNQRMXYXXJK-NSHDSACASA-N
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