4-Bromo-3-hydroxypicolinic acid
Basic information
- CAS
349471-65-4- Standard SMILES
O=C(O)c1nccc(Br)c1O- InChIKey
HTNFRWNPQNKTAU-UHFFFAOYSA-N- Molecular formula
- C6H4BrNO3
- Average molar mass
- 218 g/mol
Names & identifiers
- Preferred name
- 4-Bromo-3-hydroxypicolinic acid
- IUPAC
- 4-bromo-3-hydroxypyridine-2-carboxylic acid
- English name
- 4-Bromo-3-hydroxy-2-pyridinecarboxylic acid
- Molecular formula
- C6H4BrNO3
- Molecular weight
- 218
Names & synonyms
4-Bromo-3-hydroxypicolinic acid349471-65-44-bromo-3-hydroxypyridine-2-carboxylic acid4-Bromo-3-hydroxypicolinicacidSCHEMBL4443123ZNA47165AKOS0267433794-Bromo-3-hydroxy-2-pyridinecarboxylic acidEN300-189831F819802-Pyridinecarboxylic acid, 4-bromo-3-hydroxy-
Database identifiers
- CAS
349471-65-4
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 70.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 164
Physicochemical properties
- Boiling point
- 430.4 · 430.4±45.0 °C(Predicted)
- Density
- 1.985 · 1.985±0.06 g/cm3(Predicted)
- pka
- 7 · 7+-.0.10(Predicted)
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Related reactions
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Compound notes
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