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Molecule record

4-iodoquinoline

C9H6IN

255.06 g/mol

Loading structure

Molecular properties

Formula
C9H6IN
Molar mass
255.06 g·mol−1
Exact mass
254.9545 Da
7
PubChem CID
12691321

Functional groups

Aromatic ring
Aryl halide

Physical properties

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

Common names and synonyms

  • 16560-43-3
  • AC-25798
  • AKOS015912219
  • CS-0041400
  • DB-064578
  • DS-13371
  • DTXCID10457849
  • DTXSID20507041
Show all 18 synonyms
  • F225409
  • MFCD07700252
  • Quinoline, 4-iodo-
  • RefChem:293592
  • SB71857
  • SCHEMBL6179959
  • SCHEMBL949255
  • STERKHRCDZPNRE-UHFFFAOYSA-N
  • SY021652
  • TD8161

Structure identifiers

Canonical SMILES
Ic1ccnc2ccccc12
Isomeric SMILES
C1=CC=C2C(=C1)C(=CC=N2)I
InChI
InChI=1S/C9H6IN/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-6H
InChIKey
STERKHRCDZPNRE-UHFFFAOYSA-N
PubChem CID
12691321

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 4-iodoquinoline; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 4-iodoquinoline; not experimental data.

Sources

Molecule identity

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

PubChem(link only)
Open source record
4-iodoquinoline - Formula, Structure | ChemArche