5-(Heptyloxy)-2-(4-heptylphenyl)pyridine
Basic information
- CAS
138599-67-4- Standard SMILES
CCCCCCCOc1ccc(-c2ccc(CCCCCCC)cc2)nc1- InChIKey
GPVHSKXAHGOEPZ-UHFFFAOYSA-N- Molecular formula
- C25H37NO
- Average molar mass
- 367.6 g/mol
- Monoisotopic mass
- 367.2875148
Names & identifiers
- Preferred name
- 5-(Heptyloxy)-2-(4-heptylphenyl)pyridine
- IUPAC
- 5-heptoxy-2-(4-heptylphenyl)pyridine
Names & synonyms
138599-67-45-(HEPTYLOXY)-2-(4-HEPTYLPHENYL)PYRIDINESCHEMBL10552961DTXSID00603358
Database identifiers
- CAS
138599-67-4- PubChem CID
- 20189850
- DTXSID
DTXSID00603358
Properties
Computed structural properties
- XLogP
- 8.9
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 14
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 337
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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