Basic information
- CAS
91657-26-0- Standard SMILES
CCCCCCCCCCCCCc1ccnc(-c2cc(CCCCCCCCCCCCC)ccn2)c1- InChIKey
JSVSZYZARGPNLA-UHFFFAOYSA-N- Molecular formula
- C36H60N2
- Average molar mass
- 520.9 g/mol
- Monoisotopic mass
- 520.47564992
Names & identifiers
- Preferred name
- 4,4'-Ditridecyl-2,2'-bipyridine
- IUPAC
- 4-tridecyl-2-(4-tridecyl-2-pyridinyl)pyridine
Names & synonyms
91657-26-04,4'-DITRIDECYL-2,2'-BIPYRIDINEDTXSID50571316RefChem:284631DTXCID305220882,2'-Bipyridine, 4,4'-ditridecyl-SCHEMBL48632424,4'-ditridecyl-2,2'-bipyridyl
Database identifiers
- CAS
91657-26-0- PubChem CID
- 15313372
- DTXSID
DTXSID50571316- Nikkaji
- J932.539E
Properties
Computed structural properties
- XLogP
- 15
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 25
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 448
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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