2-(4-Chlorophenyl)-1,3-Benzothiazole

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Properties Simple | Detailed

Formula C13H8ClNS
IUPAC Name 2-(4-chlorophenyl)-1,3-benzothiazole
Molecular Mass 245.727 g·mol−1
Heat of Formation 271.1 ± 16.7 kJ·mol−1
Dipole Moment 2.63 ± 1.08 D
Volume 265.84 Å 3
Surface Area 253.99 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(4'-chlorophenyl)benzothiazole
  • 2-(4-chlorophenyl)benzothiazole
  • 2-cpbt
  • benzothiazole, 2-(4-chlorophenyl)-
  • sr-01000394318-2
CAS Number(s)
  • 6265-91-4
InChIKey GEYFXQNOTPBYPC-UHFFFAOYSA-N
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Elements H S N C Cl