Pyridine, 5-bromo-2-(3,4-dichlorophenoxy)-
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Basic information
- CAS
99902-96-2- Standard SMILES
Clc1ccc(Oc2ccc(Br)cn2)cc1Cl- InChIKey
YAHPNYGXDBHDRK-UHFFFAOYSA-N- Molecular formula
- C11H6BrCl2NO
- Average molar mass
- 318.98 g/mol
- Monoisotopic mass
- 316.90098
Names & identifiers
- Preferred name
- Pyridine, 5-bromo-2-(3,4-dichlorophenoxy)-
- IUPAC
- 5-bromo-2-(3,4-dichlorophenoxy)pyridine
- English name
- 5-bromo-2-(3,4-dichloro-phenoxy)-pyridine
- Molecular formula
- C11H6BrCl2NO
- Molecular weight
- 318.98
Names & synonyms
99902-96-25-bromo-2-(3,4-dichlorophenoxy)pyridinePyridine, 5-bromo-2-(3,4-dichlorophenoxy)-5-BROMO-2-(3,4-DICHLOROPHENOXY)-PYRIDINECHEMBL136582SCHEMBL2974010DTXSID70244338YAHPNYGXDBHDRK-UHFFFAOYSA-NAKOS0106335545-Bromo-2-(3,4-dichloro-phenoxy)-pyridine
Database identifiers
- CAS
99902-96-2- PubChem CID
- 514889
- DTXSID
DTXSID70244338- ChEMBL
CHEMBL136582
Properties
Computed structural propertiesFilling in
- XLogP
- 4.7
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 232
Physicochemical properties
- Melting point
- 73 · 73-74 °C
- Boiling point
- 370.3 · 370.3±42.0 °C(Predicted)
- Density
- 1.649 · 1.649±0.06 g/cm3(Predicted)
- pka
- -0.36 · -0.36±0.22(Predicted)
Related reactions
8 records
Compound notes
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