Basic information
- CAS
125126-75-2- Standard SMILES
COc1cc(CBr)nc(-c2cc(OC)cc(CBr)n2)c1- InChIKey
OYHSMCQTXFISPE-UHFFFAOYSA-N- Molecular formula
- C14H14Br2N2O2
- Average molar mass
- 402.08 g/mol
- Monoisotopic mass
- 399.9422
Names & identifiers
- Preferred name
- 6,6'-Bis(bromomethyl)-4,4'-dimethoxy-2,2'-bipyridine
- IUPAC
- 2-(bromomethyl)-6-[6-(bromomethyl)-4-methoxy-2-pyridinyl]-4-methoxypyridine
Names & synonyms
DTXSID5012180056,6'-Bis(bromomethyl)-4,4'-dimethoxy-2,2'-bipyridine6,6a(2)-Bis(bromomethyl)-4,4a(2)-dimethoxy-2,2a(2)-bipyridine125126-75-2
Database identifiers
- CAS
125126-75-2- PubChem CID
- 85605309
- DTXSID
DTXSID501218005
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 44.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 268
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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