Molecular properties
- Formula
- C12H7ClS
- Molar mass
- 218.71 g·mol−1
- Exact mass
- 217.9957 Da
- 9
- PubChem CID
- 527136
Molecule record
4-chlorodibenzothiophene
C12H7ClS
218.71 g/mol
Loading structure
Functional groups
Aromatic ring
Aryl halide
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 4-Chloro-dibenzothiophene
- 4-chlorodibenzo[b,d]thiophene
- 69747-68-8
- AI-942/13331577
- AT32908
- Dibenzothiophene, 4-chloro-
- HGRZBGFNEVHNDV-UHFFFAOYSA-N
- InChI=1/C12H7ClS/c13-10-6-3-5-9-8-4-1-2-7-11(8)14-12(9)10/h1-7
Show all 11 synonyms
- SCHEMBL20690712
- SCHEMBL30120535
- dibenzo[b,d]thiophene, 4-chloro-
Structure identifiers
- Canonical SMILES
- Clc1cccc2c1sc1ccccc12
- Isomeric SMILES
- C1=CC=C2C(=C1)C3=C(S2)C(=CC=C3)Cl
- InChI
- InChI=1S/C12H7ClS/c13-10-6-3-5-9-8-4-1-2-7-11(8)14-12(9)10/h1-7H
- InChIKey
- HGRZBGFNEVHNDV-UHFFFAOYSA-N
- PubChem CID
- 527136
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 4-chlorodibenzothiophene; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 4-chlorodibenzothiophene; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.