4-[(5-Bromo-2-Pyridyl)Amino]-4-Oxobutanoic Acid

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Properties Simple | Detailed

Formula C9H9BrN2O3
IUPAC Name 4-[(5-bromo-2-pyridyl)amino]-4-oxo-butanoic acid
Molecular Mass 273.083 g·mol−1
Heat of Formation -422.5 ± 16.7 kJ·mol−1
Dipole Moment 3.30 ± 1.08 D
Volume 256.14 Å 3
Surface Area 249.68 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy 2.29 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[(5-bromo-2-pyridyl)amino]-4-keto-butyric acid
  • 4-[(5-bromopyridin-2-yl)amino]-4-oxo-butanoic acid
  • 4-[(5-bromopyridin-2-yl)amino]-4-oxobutanoic acid
  • bas 00549572
  • cbdive_002953
  • iflab1_000935
  • n-(5-bromo-pyridin-2-yl)-succinamic acid
  • oprea1_146293
  • oprea1_780518
InChIKey XFYYQDHEDOXWGA-UHFFFAOYSA-N
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Elements H C O Br N