Molecule record

2-phenyl-1,3-benzothiazole

C13H9NS

211.29 g/mol

Loading structure

Molecular properties

Formula
C13H9NS
Molar mass
211.29 g·mol−1
Exact mass
211.0456 Da
10
PubChem CID
13439

Functional groups

Aromatic ring

Physical properties

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

Common names and synonyms

  • 2-PBT
  • 2-PHENYL BENZOTHIAZOLE
  • 2-Phenyl-1,3-benzothiazole #
  • 2-Phenylbenzo[d]thiazole
  • 2-Phenylbenzothiazole
  • 2-phenylbenzothiazol
  • 2-phenylbenzthiazole
  • 212-935-3
Show all 24 synonyms
  • 883-93-2
  • A842568
  • AC1645
  • AKOS000454336
  • BENZOTHIAZOLE, 2-PHENYL-
  • DTXCID10159437
  • DTXSID80236946
  • FO573G4BGT
  • HMS1424I05
  • MFCD00005777
  • NSC-1854
  • NSC-2034
  • NSC2034
  • RefChem:478139
  • SR-01000395348
  • WLN: T56 BN DSJ CR

Structure identifiers

Canonical SMILES
c1ccc(-c2nc3ccccc3s2)cc1
Isomeric SMILES
C1=CC=C(C=C1)C2=NC3=CC=CC=C3S2
InChI
InChI=1S/C13H9NS/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13/h1-9H
InChIKey
XBHOUXSGHYZCNH-UHFFFAOYSA-N
PubChem CID
13439

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-phenyl-1,3-benzothiazole; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-phenyl-1,3-benzothiazole; 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