Basic information
- CAS
34541-29-2- Standard SMILES
CC(C)CC(=O)Cc1ccccn1- InChIKey
XEVXNPTXPGBOTN-UHFFFAOYSA-N- Molecular formula
- C11H15NO
- Average molar mass
- 177.24 g/mol
- Monoisotopic mass
- 177.1153641
Names & identifiers
- Preferred name
- 4-Methyl-1-(pyridin-2-yl)pentan-2-one
- IUPAC
- 4-methyl-1-pyridin-2-ylpentan-2-one
Names & synonyms
4-Methyl-1-(pyridin-2-yl)pentan-2-one34541-29-2DTXSID60488441
Database identifiers
- CAS
34541-29-2- PubChem CID
- 12320587
- DTXSID
DTXSID60488441
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 30 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 165
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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