2,2'-Bipyridine, 6,6'-dibutyl-
Basic information
- CAS
61633-07-6- Standard SMILES
CCCCc1cccc(-c2cccc(CCCC)n2)n1- InChIKey
ZJENZRQSFPCKHG-UHFFFAOYSA-N- Molecular formula
- C18H24N2
- Average molar mass
- 268.4 g/mol
- Monoisotopic mass
- 268.19394877
Names & identifiers
- Preferred name
- 2,2'-Bipyridine, 6,6'-dibutyl-
- IUPAC
- 2-butyl-6-(6-butyl-2-pyridinyl)pyridine
- English name
- 2-butyl-6-(6-butylpyridin-2-yl)pyridine
- Molecular formula
- C18H24N2
- Molecular weight
- 268.4
Names & synonyms
6,6'-Dibutyl-2,2'-bipyridine61633-07-62,2'-Bipyridine, 6,6'-dibutyl-MFCD283410832-BUTYL-6-(6-BUTYLPYRIDIN-2-YL)PYRIDINEDTXSID904875632-butyl-6-(6-butyl-2-pyridyl)pyridineF75828
Database identifiers
- CAS
61633-07-6- PubChem CID
- 12316111
- DTXSID
DTXSID90487563
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 228
Physicochemical properties
- Boiling point
- 80 · 80-83 °C(Press: 0.01 Torr)
- Density
- 0.983 · 0.983±0.06 g/cm3(Predicted)
- pka
- 5.07 · 5.07±0.34(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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