Molecular properties
- Formula
- C7H5IO
- Molar mass
- 232.02 g·mol−1
- Exact mass
- 231.9385 Da
- 5
- PubChem CID
- 252610
Molecule record
3-iodobenzaldehyde
C7H5IO
232.02 g/mol
Loading structure
Functional groups
Aldehyde
Aromatic ring
Aryl halide
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 3-Iodo-benzaldehyde
- 3-Iodobenzaldehyde, 97%
- 3-iodanylbenzaldehyde
- 626-706-4
- 696-41-3
- AKOS000478333
- Benzaldehyde, 3-iodo-
- CS-W007699
Show all 24 synonyms
- DTXCID30242436
- DTXSID80291292
- FI70244
- FT-0615893
- MFCD00039573
- NSC-74694
- NSC74694
- PS-6040
- RefChem:502754
- SBB064701
- SCHEMBL29794189
- SCHEMBL97068
- SCHEMBL97069
- STK788481
- Z57887683
- m-Jodbenzaldehyd
Structure identifiers
- Canonical SMILES
- O=Cc1cccc(I)c1
- Isomeric SMILES
- C1=CC(=CC(=C1)I)C=O
- InChI
- InChI=1S/C7H5IO/c8-7-3-1-2-6(4-7)5-9/h1-5H
- InChIKey
- RZODAQZAFOBFLS-UHFFFAOYSA-N
- PubChem CID
- 252610
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 3-iodobenzaldehyde; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3-iodobenzaldehyde; not experimental data.
Sources
Molecule identity
Retrieved 8/19/2026. Reuse status is summarized by the badge; open the source for full details.