Molecule record

2-phenylbenzotriazole

C12H9N3

195.22 g/mol

Loading structure

Molecular properties

Formula
C12H9N3
Molar mass
195.22 g·mol−1
Exact mass
195.0796 Da
10
PubChem CID
154096

Functional groups

Aromatic ring

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 1916-72-9
  • 2-Phenyl-2H-1,2,3-benzotriazole
  • 2-Phenyl-2H-benzo[d][1,2,3]triazole
  • 2-Phenyl-2H-benzotriazole
  • 2H-Benzotriazole, 2-phenyl-
  • AF-628/30886022
  • AKOS004900710
  • CHEMBL1578171
Show all 22 synonyms
  • DTXCID4095184
  • DTXSID80172693
  • HMS2363C22
  • MLS000550466
  • NCGC00247175-01
  • RefChem:910405
  • SCHEMBL11582651
  • SCHEMBL1428273
  • SCHEMBL1428276
  • SCHEMBL459011
  • SCHEMBL6506643
  • SCHEMBL9658789
  • SMR000114068
  • Y11311

Structure identifiers

Canonical SMILES
c1ccc(-n2nc3ccccc3n2)cc1
Isomeric SMILES
C1=CC=C(C=C1)N2N=C3C=CC=CC3=N2
InChI
InChI=1S/C12H9N3/c1-2-6-10(7-3-1)15-13-11-8-4-5-9-12(11)14-15/h1-9H
InChIKey
XJRLKUOFBZMRBR-UHFFFAOYSA-N
PubChem CID
154096

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 2-phenylbenzotriazole; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-phenylbenzotriazole; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record