4-(4-Ethylbenzyl)-3-hydroxypyridine
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Basic information
- CAS
776317-35-2- Standard SMILES
CCc1ccc(Cc2ccncc2O)cc1- InChIKey
SQUBLQHUGHZFBB-UHFFFAOYSA-N- Molecular formula
- C14H15NO
- Average molar mass
- 213.27 g/mol
- Monoisotopic mass
- 213.1153641
Names & identifiers
- Preferred name
- 4-(4-Ethylbenzyl)-3-hydroxypyridine
- IUPAC
- 4-[(4-ethylphenyl)methyl]pyridin-3-ol
- English name
- 3-Pyridinol,4-[(4-ethylphenyl)methyl]-(9CI)
- Molecular formula
- C14H15NO
- Molecular weight
- 213.275
Names & synonyms
776317-35-2SCHEMBL4852032SQUBLQHUGHZFBB-UHFFFAOYSA-N4-(4-ethylbenzyl)-3-hydroxypyridine3-Pyridinol, 4-[(4-ethylphenyl)methyl]-DB-2832013-Pyridinol,4-[(4-ethylphenyl)methyl]-(9CI)
Database identifiers
- CAS
776317-35-2- PubChem CID
- 23103643
Properties
Computed structural propertiesFilling in
- XLogP
- 3.2
- Topological polar surface area
- 33.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 199
Related reactions
2 records
Compound notes
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