Molecular properties
- Formula
- C8H7IO
- Molar mass
- 246.05 g·mol−1
- Exact mass
- 245.9542 Da
- 5
- PubChem CID
- 138307
Molecule record
2-iodo-1-phenylethanone
C8H7IO
246.05 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Alkyl halide
Aromatic ring
Ketone
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 2-IODOACETOPHENONE
- 2-iodo-1-phenyl-ethanone
- 2-iodo-1-phenylethan-1-one
- 4636-16-2
- DTXCID70119310
- DTXSID80196819
- Ethanone, 2-iodo-1-phenyl-
- MFCD00972007
Show all 13 synonyms
- RefChem:341434
- SCHEMBL171752
- SCHEMBL9489397
- SY573934
- phenacyl iodide
Structure identifiers
- Canonical SMILES
- O=C(CI)c1ccccc1
- Isomeric SMILES
- C1=CC=C(C=C1)C(=O)CI
- InChI
- InChI=1S/C8H7IO/c9-6-8(10)7-4-2-1-3-5-7/h1-5H,6H2
- InChIKey
- CREOHKRPSSUXCW-UHFFFAOYSA-N
- PubChem CID
- 138307
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 2-iodo-1-phenylethanone; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-iodo-1-phenylethanone; not experimental data.
Sources
Molecule identity
Retrieved 8/19/2026. Reuse status is summarized by the badge; open the source for full details.