6-Bromo-2-(4-hydroxyphenyl)quinoline-4-carboxylic acid
Basic information
- CAS
351443-08-8- Standard SMILES
O=C(O)c1cc(-c2ccc(O)cc2)nc2ccc(Br)cc12- InChIKey
UGYLWYNSKRKEBR-UHFFFAOYSA-N- Molecular formula
- C16H10BrNO3
- Average molar mass
- 344.16 g/mol
- Monoisotopic mass
- 342.98441
Names & identifiers
- Preferred name
- 6-Bromo-2-(4-hydroxyphenyl)quinoline-4-carboxylic acid
- IUPAC
- 6-bromo-2-(4-hydroxyphenyl)quinoline-4-carboxylic acid
- English name
- 6-Bromo-2-(4-hydroxyphenyl)quinoline-4-carboxylic acid
- Molecular formula
- C16H10BrNO3
- Molecular weight
- 344.16
Names & synonyms
6-bromo-2-(4-hydroxyphenyl)quinoline-4-carboxylic acid351443-08-8MFCD018126024-Quinolinecarboxylic acid, 6-bromo-2-(4-hydroxyphenyl)-CBMicro_008651CCG-2598Oprea1_363506Oprea1_638657SCHEMBL5530291DTXSID00416809ALBB-011591SMSF0005697
Show more names
STK438841AKOS000263998CB11293SB72252VS-05764BIM-0008640.P001CS-0317992ST50844423
Database identifiers
- CAS
351443-08-8- PubChem CID
- 779977
- DTXSID
DTXSID00416809
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 70.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 384
Physicochemical properties
- Melting point
- 320 °C · >320 °C(Solv: acetic acid (64-19-7))
- Boiling point
- 544.8 · 544.8±50.0 °C(Predicted)
- Density
- 1.645 · 1.645±0.06 g/cm3(Predicted)
- pka
- 0.82 · 0.82±0.30(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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