1-(5-Bromo-2-hydroxy-3-methylphenyl)propan-1-one
Basic information
- CAS
2887-56-1- Standard SMILES
CCC(=O)c1cc(Br)cc(C)c1O- InChIKey
SKZDSFWVNVYIIY-UHFFFAOYSA-N- Molecular formula
- C10H11BrO2
- Average molar mass
- 243.1 g/mol
- Monoisotopic mass
- 241.99424
Names & identifiers
- Preferred name
- 1-(5-Bromo-2-hydroxy-3-methylphenyl)propan-1-one
- IUPAC
- 1-(5-bromo-2-hydroxy-3-methylphenyl)propan-1-one
- English name
- 1-(5-bromo-2-hydroxy-3-methyl-phenyl)propan-1-one
- Molecular formula
- C10H11BrO2
- Molecular weight
- 243.09714
Names & synonyms
1-(5-bromo-2-hydroxy-3-methylphenyl)propan-1-one2887-56-1Propiophenone, 5-bromo-2-hydroxy-3-methyl-1-(5-bromo-2-hydroxy-3-methylphenyl)-1-propanoneSCHEMBL17210813DTXSID00183069MFCD01104011AKOS012519290SY373313CS-0295697ST50997231Propiophenone, 5-bromo-2-hydroxy-3-methyl-,
Show more names
1-(5-bromo-2-hydroxy-3-methyl-phenyl)propan-1-one
EN300-142128Propiophenone, 5'-bromo-2'-hydroxy-3'-methyl-
Database identifiers
- CAS
2887-56-1- PubChem CID
- 137757
- DTXSID
DTXSID00183069
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Melting point
- 69 °C · 69°C
Chemistry & industry
Preparation methods
PreparationPreparation by bromination –– of 2-hydroxy-3- methyl-propiophenone with bromine.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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