5-Chloro-3-Methyl-1-Phenyl Pyrazole-4-Alldehyde

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Properties Simple | Detailed

Formula C11H9ClN2O
IUPAC Name 5-chloro-3-methyl-1-phenyl-pyrazole-4-carbaldehyde
Molecular Mass 220.655 g·mol−1
Heat of Formation 130.7 ± 16.7 kJ·mol−1
Dipole Moment 4.37 ± 1.08 D
Volume 246.73 Å 3
Surface Area 234.87 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy 2.07 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-pyrazole-4-carboxaldehyde, 5-chloro-3-methyl-1-phenyl-
  • 5-chloro-3-methyl-1-phenyl-4-pyrazolecarboxaldehyde
  • 5-chloro-3-methyl-1-phenyl-pyrazole-4-carbaldehyde
  • 5-chloro-3-methyl-1-phenylpyrazole-4-carbaldehyde
  • pyrazole-4-carboxaldehyde, 5-chloro-3-methyl-1-phenyl-
CAS Number(s)
  • 947-95-5
InChIKey DKZPJLZXLKAMDO-UHFFFAOYSA-N
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Elements H C N O Cl