3-(4-Methyl-2,5-Dioxo-2,5-Dihydro-1H-Pyrrol-3-Yl)Propanoic Acid

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Properties Simple | Detailed

Formula C8H9NO4
IUPAC Name 3-(4-methyl-2,5-dioxo-pyrrol-3-yl)propanoic acid
Molecular Mass 183.161 g·mol−1
Heat of Formation -691.6 ± 16.7 kJ·mol−1
Dipole Moment 2.28 ± 1.08 D
Volume 211.02 Å 3
Surface Area 205.58 Å 2
HOMO Energy -10.86 ± 0.55 eV
LUMO Energy -1.48 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-pyrrole-3-propanoic acid, 2,5-dihydro-4-methyl-2,5-dioxo-
  • 2,5-dihydro-4-methyl-2,5-dioxo-1h-pyrrole-3-propanoic acid
  • 3-(2,5-diketo-4-methyl-3-pyrrolin-3-yl)propionic acid
  • 3-(4-methyl-2,5-dioxo-3-pyrrolyl)propanoic acid
  • 3-(4-methyl-2,5-dioxopyrrol-3-yl)propanoic acid
  • hematinic acid
CAS Number(s)
  • 487-65-0
InChIKey ZAFOEDODWZIXMO-UHFFFAOYSA-N
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