N-(Bromoacetyl)-L-Phenylalanine

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Properties Simple | Detailed

Formula C11H12BrNO3
IUPAC Name (2s)-2-[(2-bromoacetyl)amino]-3-phenyl-propanoic acid
Molecular Mass 286.122 g·mol−1
Heat of Formation -490.3 ± 16.7 kJ·mol−1
Dipole Moment 3.42 ± 1.08 D
Volume 282.68 Å 3
Surface Area 242.96 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -0.26 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-(2-bromoethanoylamino)-3-phenyl-propanoic acid
  • (2s)-2-[(2-bromo-1-oxoethyl)amino]-3-phenylpropanoic acid
  • (2s)-2-[(2-bromoacetyl)amino]-3-phenyl-propanoic acid
  • (2s)-2-[(2-bromoacetyl)amino]-3-phenyl-propionic acid
  • (2s)-2-[(2-bromoacetyl)amino]-3-phenylpropanoic acid
  • l-phenylalanine, n-(bromoacetyl)-
  • n-bromoacetylphenylalanine
CAS Number(s)
  • 36753-68-1
InChIKey VTPIBSARWNWKDF-VIFPVBQESA-N
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Elements H C O Br N