2-Methyl-4-(1,3-Thiazol-5-Yl)-1(2H)-Phthalazinone

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Properties Simple | Detailed

Formula C12H9N3OS+
IUPAC Name 2-methyl-4-thiazol-5-yl-phthalazin-1-one
Molecular Mass 243.284 g·mol−1
Heat of Formation 228.7 ± 16.7 kJ·mol−1
Dipole Moment 1.53 ± 1.08 D
Volume 268.54 Å 3
Surface Area 249.44 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -1.12 ± eV
Point Group Symmetry C1
Synonyms
  • 2-methyl-4-(1,3-thiazol-5-yl)phthalazin-1-one
  • 2-methyl-4-(5-thiazolyl)-1(2h)-phthalazinone
  • 2-methyl-4-(5-thiazolyl)-1-phthalazinone
  • kk 562
  • kk-562
CAS Number(s)
  • 137382-10-6
InChIKey KYHISOZRMVLEAX-UHFFFAOYSA-N
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