Ethyl 1-(4-Methoxyphenyl)-3,5-Dimethyl-1H-Pyrazole-4-Carboxylate

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Properties Simple | Detailed

Formula C15H18N2O3
IUPAC Name ethyl 1-(4-methoxyphenyl)-3,5-dimethyl-pyrazol-1-ium-3-ylium-4-carboxylate
Molecular Mass 274.315 g·mol−1
Heat of Formation -319.5 ± 16.7 kJ·mol−1
Dipole Moment 5.84 ± 1.08 D
Volume 334.09 Å 3
Surface Area 307.99 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy 2.58 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(4-methoxyphenyl)-3,5-dimethyl-1h-pyrazole-4-carboxylic acid ethyl ester
  • 1-(4-methoxyphenyl)-3,5-dimethyl-4-pyrazolecarboxylic acid ethyl ester
  • 1-(4-methoxyphenyl)-3,5-dimethyl-pyrazole-4-carboxylic acid ethyl ester
  • 4de
  • ba-0846
  • ethyl 1-(4-methoxyphenyl)-3,5-dimethyl-pyrazole-4-carboxylate
  • ethyl 1-(4-methoxyphenyl)-3,5-dimethylpyrazole-4-carboxylate
InChIKey ZDSXCFSUGVAQSB-UHFFFAOYSA-N
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