4-Hydroxy-5-Undecyl-1,3-Benzothiazole-6,7-Dione

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Properties Simple | Detailed

Formula C18H25NO3S
IUPAC Name 4-hydroxy-5-undecyl-1,3-benzothiazole-6,7-dione
Molecular Mass 335.461 g·mol−1
Heat of Formation -424.2 ± 16.7 kJ·mol−1
Dipole Moment 3.06 ± 1.08 D
Volume 422.37 Å 3
Surface Area 391.26 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy -2.13 ± eV
Point Group Symmetry C1
Synonyms
  • 3-undecyl-2-hydroxydioxobenzothiazol
  • 4,7-benzothiazoledione, 6-hydroxy-5-undecyl-
  • 4-hydroxy-5-undecyl-1,3-benzothiazole-6,7-quinone
  • 6-hydroxy-5-undecyl-1,3-benzothiazole-4,7-dione
  • 6-hydroxy-5-undecyl-4,7-benzothiazoledione
  • uhd
  • uhdbt
CAS Number(s)
  • 43152-58-5
InChIKey VSIBLXWNANVQDH-UHFFFAOYSA-N
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