Ethyl 5-Amino-1H-Pyrazole-4-Carboxylate

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Properties Simple | Detailed

Formula C6H9N3O2
IUPAC Name ethyl 5-aminopyrazol-1-ium-2-ide-4-carboxylate
Molecular Mass 155.155 g·mol−1
Heat of Formation -209.5 ± 16.7 kJ·mol−1
Dipole Moment 2.22 ± 1.08 D
Volume 180.2 Å 3
Surface Area 185.51 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy 3.06 ± eV
Point Group Symmetry C1
Synonyms
  • 3-amino-2h-pyrazole-4-carboxylic acid ethyl ester
  • 3-amino-4-carbethoxypyrazole
  • 3-amino-4-ethoxycarbonylpyrazole
  • chemdiv2_008143
  • ethyl 3-amino-1h-pyrazole-4-carboxylate
  • ethyl 3-amino-2h-pyrazole-4-carboxylate
  • ethyl 3-amino-4-pyrazolecarboxylate
  • zero/002887
CAS Number(s)
  • 6994-25-8
InChIKey YPXGHKWOJXQLQU-UHFFFAOYSA-N
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