2-[2-(4-Methoxyphenyl)ethyl]pyridine
Basic information
- CAS
46739-62-2- Standard SMILES
COc1ccc(CCc2ccccn2)cc1- InChIKey
ACZSUOYUNBXYLN-UHFFFAOYSA-N- Molecular formula
- C14H15NO
- Average molar mass
- 213.27 g/mol
- Monoisotopic mass
- 213.1153641
Names & identifiers
- Preferred name
- 2-[2-(4-Methoxyphenyl)ethyl]pyridine
- IUPAC
- 2-[2-(4-methoxyphenyl)ethyl]pyridine
Names & synonyms
AKOS015996476
Database identifiers
- CAS
46739-62-2- PubChem CID
- 408522
- Nikkaji
- J1.568.481J
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 187
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Compound notes
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