1H-Benzotriazole-5-Carboxylic Acid

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Properties Simple | Detailed

Formula C7H5N3O2
IUPAC Name 2h-benzotriazole-5-carboxylic acid
Molecular Mass 163.133 g·mol−1
Heat of Formation -1.9 ± 16.7 kJ·mol−1
Dipole Moment 2.20 ± 1.08 D
Volume 173.47 Å 3
Surface Area 175.36 Å 2
HOMO Energy -9.85 ± 0.55 eV
LUMO Energy 1.52 ± eV
Point Group Symmetry Cs
Synonyms
  • 1h-benzotriazolecarboxylic acid
  • 2h-benzotriazole-5-carboxylic acid
  • 3h-benzotriazole-5-carboxylic acid
  • bas 00015436
  • benzotriazole-5-cooh
  • cds1_000213
  • oprea1_101982
  • oprea1_856379
CAS Number(s)
  • 60932-58-3
  • 23814-12-2
InChIKey GUOVBFFLXKJFEE-UHFFFAOYSA-N
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