Molecular properties
- Formula
- C8H7IO
- Molar mass
- 246.05 g·mol−1
- Exact mass
- 245.9542 Da
- 5
- PubChem CID
- 84449
Molecule record
1-(3-iodophenyl)ethanone
C8H7IO
246.05 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Aryl halide
Ketone
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 1-(3-Iodophenyl)ethanone #
- 1-(3-Iodophenyl)ethanone; 3-Acetyl-1-iodobenzene; m-Iodoacetophenone; 1-(3-Iodophenyl)-ethanone;
- 1-(3-iodo-phenyl)-ethanone
- 1-(3-iodophenyl)ethan-1-one
- 14452-30-3
- 3'-Iodoacetophenone
- 3'-Iodoacetophenone, 97%
- 3'-iodo acetophenone
Show all 24 synonyms
- 627-958-8
- AC-3643
- AKOS005258741
- CK2572
- CS-W010241
- DB-010013
- DS-18475
- DTXCID7034703
- DTXSID5065770
- Ethanone, 1-(3-iodophenyl)-
- FI64536
- MFCD00060283
- RefChem:592472
- SCHEMBL172793
- SCHEMBL2093436
- SY109511
Structure identifiers
- Canonical SMILES
- CC(=O)c1cccc(I)c1
- Isomeric SMILES
- CC(=O)C1=CC(=CC=C1)I
- InChI
- InChI=1S/C8H7IO/c1-6(10)7-3-2-4-8(9)5-7/h2-5H,1H3
- InChIKey
- IWLHOUBDKCKJJQ-UHFFFAOYSA-N
- PubChem CID
- 84449
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 1-(3-iodophenyl)ethanone; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 1-(3-iodophenyl)ethanone; not experimental data.
Sources
Molecule identity
Retrieved 8/19/2026. Reuse status is summarized by the badge; open the source for full details.