Basic information
- CAS
63923-67-1- Standard SMILES
CC(O)(Br)C(=O)c1ccccc1- InChIKey
QIVHEZVOMZSRBC-UHFFFAOYSA-N- Molecular formula
- C9H9BrO2
- Average molar mass
- 229.07 g/mol
- Monoisotopic mass
- 227.97859
Names & identifiers
- Preferred name
- 2-Bromo-2-hydroxy-1-phenylpropan-1-one
- IUPAC
- 2-bromo-2-hydroxy-1-phenylpropan-1-one
- English name
- 2-bromo-2-hydroxypropiophenone
- Molecular formula
- C9H9BrO2
- Molecular weight
- 229.07
Names & synonyms
2-Bromo-2-hydroxy-1-phenylpropan-1-one63923-67-1DTXSID506984762-bromo-2-hydroxypropiophenone2-bromo-1-(2-hydroxyphenyl)propan-1-one1-Propanone, 2-bromo-1-(2-hydroxyphenyl)-
Database identifiers
- CAS
63923-67-1- PubChem CID
- 53424331
- DTXSID
DTXSID50698476
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 175
Physicochemical properties
- Melting point
- 32 °C · 32 °C
- Boiling point
- 117 · 117-122 °C(Press: 4 Torr)
- Density
- 1.533 · 1.533±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 7.687 · 7.687±0.30(predicted)
Chemistry & industry
Suppliers6 total
ecochem international chemical broker[email protected]
HONEST JOY HOLDINGS LIMITED[email protected]
EUROLABS—
常州科莱博化工有限公司—
Service Chemical Inc.[email protected]
kemikalieimport[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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