2-Amino-4-Chlorobenzothiazole

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Properties Simple | Detailed

Formula C7H5ClN2S
IUPAC Name 4-chloro-1,3-benzothiazol-2-amine
Molecular Mass 184.646 g·mol−1
Heat of Formation 166.6 ± 16.7 kJ·mol−1
Dipole Moment 3.57 ± 1.08 D
Volume 190.26 Å 3
Surface Area 188.37 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy 1.94 ± eV
Point Group Symmetry C1
Synonyms
  • (4-chloro-1,3-benzothiazol-2-yl)amine
  • 2-benzothiazolamine, 4-chloro-
  • 4-chlorobenzothiazol-2-ylamine
  • benzothiazole, 2-amino-4-chloro-
CAS Number(s)
  • 19952-47-7
InChIKey OEQQFQXMCPMEIH-UHFFFAOYSA-N
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Elements H C Cl S N