3-Amino-1-(3-Trifluoromethylphenyl)-6-Methyl-1H-Pyridazin-4-One

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Properties Simple | Detailed

Formula C12H10F3N3O
IUPAC Name 3-amino-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one
Molecular Mass 269.223 g·mol−1
Heat of Formation 1385.5 ± 16.7 kJ·mol−1
Dipole Moment 3.78 ± 1.08 D
Volume 278.38 Å 3
Surface Area 264.44 Å 2
HOMO Energy -10.10 ± 0.55 eV
LUMO Energy -1.49 ± eV
Point Group Symmetry C1
Synonyms
  • 3-amino-6-methyl-1-[3-(trifluoromethyl)phenyl]-4-pyridazinone
  • 3-amino-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one
InChIKey MRMGTEKECRMLOG-UHFFFAOYSA-N
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