Basic information
- Standard SMILES
CC(=O)c1cccc(CCCO)n1- InChIKey
QFRWOXYAJPVDCJ-UHFFFAOYSA-N- Molecular formula
- C10H13NO2
- Average molar mass
- 179.22 g/mol
Names & identifiers
- Preferred name
- 2-Acetyl-6-(3-hydroxypropyl)-pyridine
- IUPAC
- 1-[6-(3-hydroxypropyl)-2-pyridinyl]ethanone
Names & synonyms
SCHEMBL8662483QFRWOXYAJPVDCJ-UHFFFAOYSA-N2-acetyl-6-(3-hydroxypropyl)-pyridine
Database identifiers
- PubChem CID
- 19082007
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 170
Related reactions
5 records
Compound notes
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