Basic information
- CAS
1364125-21-2- Standard SMILES
COCCOCCOc1cc(Br)cnc1-c1ncc(Br)cc1OCCOCCOC- InChIKey
WDNCRPUNYWQWNA-UHFFFAOYSA-N- Molecular formula
- C20H26Br2N2O6
- Average molar mass
- 550.2 g/mol
- Monoisotopic mass
- 548.01576
Names & identifiers
- Preferred name
- 5,5'-Dibromo-3,3'-bis[2-(2-methoxyethoxy)ethoxy]-2,2'-bipyridine
- IUPAC
- 5-bromo-2-[5-bromo-3-[2-(2-methoxyethoxy)ethoxy]-2-pyridinyl]-3-[2-(2-methoxyethoxy)ethoxy]pyridine
Names & synonyms
DTXSID1011656505,5'-dibromo-3,3'-bis[2-(2-methoxyethoxy)ethoxy]-2,2'-bipyridine2,2a(2)-Bipyridine, 5,5a(2)-dibromo-3,3a(2)-bis[2-(2-methoxyethoxy)ethoxy]-1364125-21-2
Database identifiers
- CAS
1364125-21-2- PubChem CID
- 102257519
- DTXSID
DTXSID101165650- Nikkaji
- J2.896.114F
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 81.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 15
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 402
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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