N-Benzyl-1H-Benzotriazol-1-Amine

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Properties Simple | Detailed

Formula C13H12N4
IUPAC Name n-benzylbenzotriazol-1-ium-2-id-1-amine
Molecular Mass 224.261 g·mol−1
Heat of Formation 540.6 ± 16.7 kJ·mol−1
Dipole Moment 3.87 ± 1.08 D
Volume 272.72 Å 3
Surface Area 257.18 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
Synonyms
  • 1-bbt
  • 1h-benzotriazol-1-amine, n-(phenylmethyl)-
  • 1h-benzotriazole, 1-(phenylmethylamino)-
  • benzotriazol-1-yl-(benzyl)amine
  • n-(phenylmethyl)-1-benzotriazolamine
  • n-(phenylmethyl)-1h-benzotriazol-1-amine
  • n-(phenylmethyl)benzotriazol-1-amine
  • n-benzyl-1-aminobenzotriazole
CAS Number(s)
  • 105026-59-3
InChIKey WTBFBDRLXNOOGE-UHFFFAOYSA-N
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Elements H C N