1H-Benzotriazole, 1-Acetyl-

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Properties Simple | Detailed

Formula C8H7N3O
IUPAC Name 1-(benzotriazol-1-yl)ethanone
Molecular Mass 161.161 g·mol−1
Heat of Formation 146.1 ± 16.7 kJ·mol−1
Dipole Moment 1.27 ± 1.08 D
Volume 183.93 Å 3
Surface Area 184.01 Å 2
HOMO Energy -9.71 ± 0.55 eV
LUMO Energy -1.09 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-(1-benzotriazolyl)ethanone
  • 1-(benzotriazol-1-yl)ethanone
  • 1-acetyl-1h-1,2,3-benzotriazole
  • 1h-1,2,3-benzotriazole, 1-acetyl-
  • n-acetylbenzotriazole
CAS Number(s)
  • 18773-93-8
InChIKey NIIUIBKEGRPPDK-UHFFFAOYSA-N
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