Methyl 4-Azido-N-(Bromoacetyl)-L-Phenylalaninate

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Properties Simple | Detailed

Formula C12H13BrN4O3
IUPAC Name methyl (2s)-3-(4-azidophenyl)-2-[(2-bromoacetyl)amino]propanoate
Molecular Mass 341.161 g·mol−1
Heat of Formation -144.6 ± 16.7 kJ·mol−1
Dipole Moment 2.73 ± 1.08 D
Volume 347.45 Å 3
Surface Area 302.81 Å 2
HOMO Energy -9.90 ± 0.55 eV
LUMO Energy -0.86 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-3-(4-azidophenyl)-2-[(2-bromo-1-oxoethyl)amino]propanoic acid methyl ester
  • (2s)-3-(4-azidophenyl)-2-[(2-bromoacetyl)amino]propionic acid methyl ester
  • bapm
  • l-phenylalanine, 4-azido-n-(bromoacetyl)-, methyl ester
  • methyl (2s)-3-(4-azidophenyl)-2-(2-bromoethanoylamino)propanoate
  • methyl (2s)-3-(4-azidophenyl)-2-[(2-bromoacetyl)amino]propanoate
  • n-bromoacetyl-4-azido-l-phenylalanine methyl ester
  • n-bromoacetyl-p-azido-l-phenylalanine methyl ester
CAS Number(s)
  • 65615-88-5
InChIKey WIVOZTXRSUHINO-JTQLQIEISA-N
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Elements H C O Br N