2-(4-Methylphenyl)-4-Benzothiazolol

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Properties Simple | Detailed

Formula C14H11NOS
IUPAC Name 2-(p-tolyl)-1,3-benzothiazol-4-ol
Molecular Mass 241.308 g·mol−1
Heat of Formation 97.6 ± 16.7 kJ·mol−1
Dipole Moment 0.74 ± 1.08 D
Volume 277.72 Å 3
Surface Area 263.14 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.89 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(4-methylphenyl)-1,3-benzothiazol-4-ol
  • 4-benzothiazolol, 2-(4-methylphenyl)-
  • 4-hydroxy-2-(4-methylphenyl)benzothiazole
  • kb 2714
  • kb-2714
CAS Number(s)
  • 122589-83-7
InChIKey XYVBFHRLFOBGMT-UHFFFAOYSA-N
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