8-Hydroxy-1-[2-(4-methoxyphenyl)-2-oxoethyl]quinolin-1-ium bromide
Basic information
- CAS
7478-48-0- Standard SMILES
COc1ccc(C(=O)C[n+]2cccc3cccc(O)c32)cc1.[Br-]- InChIKey
RTYLFDGFCREDEZ-UHFFFAOYSA-N- Molecular formula
- C18H16BrNO3
- Average molar mass
- 374.2 g/mol
- Monoisotopic mass
- 373.03136
Names & identifiers
- Preferred name
- 8-Hydroxy-1-[2-(4-methoxyphenyl)-2-oxoethyl]quinolin-1-ium bromide
- IUPAC
- 2-(8-hydroxyquinolin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide
Names & synonyms
7478-48-0DTXSID90639641NSC402931NSC-4029318-Hydroxy-1-[2-(4-methoxyphenyl)-2-oxoethyl]quinolin-1-ium bromide
Database identifiers
- CAS
7478-48-0- PubChem CID
- 24201062
- DTXSID
DTXSID90639641
Properties
Computed structural properties
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 379
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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