Molecular properties
- Formula
- C9H5BrO2
- Molar mass
- 225.04 g·mol−1
- Exact mass
- 223.9473 Da
- 7
- PubChem CID
- 521256
Molecule record
3-bromochromen-4-one
C9H5BrO2
225.04 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
- 3-Bromo chromone
- 3-Bromo-4-oxo-4H-1-benzopyran
- 3-Bromo-4H-1-benzopyran-4-one
- 3-Bromo-4H-chromen-4-one
- 3-Bromo-4H-chromen-4-one #
- 3-Bromo-4H-chromene-4-one
- 3-Bromochromone
- 3-Bromochromone, 97%
Show all 24 synonyms
- 49619-82-1
- 4H-1-Benzopyran-4-one,3-bromo-
- 676-483-2
- AKOS005199054
- AS-18862
- B3334
- DTXCID90285682
- DTXSID80334592
- HMS558N10
- IQIGYNPOESZBDJ-UHFFFAOYSA-N
- MFCD00017337
- Maybridge1_006104
- N11981
- RefChem:93242
- SBB096767
- SCHEMBL312373
Structure identifiers
- Canonical SMILES
- O=c1c(Br)coc2ccccc12
- Isomeric SMILES
- C1=CC=C2C(=C1)C(=O)C(=CO2)Br
- InChI
- InChI=1S/C9H5BrO2/c10-7-5-12-8-4-2-1-3-6(8)9(7)11/h1-5H
- InChIKey
- IQIGYNPOESZBDJ-UHFFFAOYSA-N
- PubChem CID
- 521256
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-bromochromen-4-one; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3-bromochromen-4-one; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.