Pyridaben

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Properties Simple | Detailed

Formula C19H25ClN2OS
IUPAC Name 2-tert-butyl-5-[(4-tert-butylphenyl)methylsulfanyl]-4-chloro-pyridazin-3-one
Molecular Mass 364.933 g·mol−1
Heat of Formation -100.5 ± 16.7 kJ·mol−1
Dipole Moment 2.04 ± 1.08 D
Volume 440.31 Å 3
Surface Area 376.73 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
Synonyms
  • 2-tert-butyl-5-(4-tert-butyl-benzylthio)-4-chloropyridazin-3(2h)-one
  • 2-tert-butyl-5-[(4-tert-butylbenzyl)sulfanyl]-4-chloro-3(2h)-pyridazinone
  • 2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloro-pyridazin-3-one
  • 2-tert-butyl-5-[(4-tert-butylbenzyl)thio]-4-chloropyridazin-3(2h)-one
  • 2-tert-butyl-5-[(4-tert-butylphenyl)methylsulfanyl]-4-chloropyridazin-3-one
  • 2-tert-butyl-5-[(4-tert-butylphenyl)methylthio]-4-chloro-3-pyridazinone
  • 3(2h)-pyridazinone, 4-chloro-2-(1,1-dimethylethyl)-5-(((4-(1,1-dimethylethyl)phenyl)methyl)thio)-
  • 4-chloro-2-(1,1-dimethylethyl)-5-(((4-(1,1-dimethylethyl)phenyl)methyl)thio)-3(2h)-pyridazinone
  • ee4057003
  • ks-1098
  • sanmite
CAS Number(s)
  • 96489-71-3
InChIKey DWFZBUWUXWZWKD-UHFFFAOYSA-N
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