Methyl 3-(2-Furyl)-5-Methyl-1H-Pyrazole-4-Carboxylate

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Properties Simple | Detailed

Formula C10H10N2O3
IUPAC Name methyl 5-furan-1-ium-2-ylium-2-yl-3-methyl-pyrazol-1-ium-4-ide-4-carboxylate
Molecular Mass 206.198 g·mol−1
Heat of Formation -213.7 ± 16.7 kJ·mol−1
Dipole Moment 3.63 ± 1.08 D
Volume 236.08 Å 3
Surface Area 224.57 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy 2.29 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(2-furyl)-5-methyl-1h-pyrazole-4-carboxylic acid methyl ester
  • methyl 3-furan-2-yl-5-methyl-1h-pyrazole-4-carboxylate
  • sr-01000640309-1
InChIKey QIPOGDVPLFLWHT-UHFFFAOYSA-N
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