Pyridine, 1,2-dihydro-1-(1-oxobutyl)-
Basic information
- CAS
849947-72-4- Standard SMILES
CCCC(=O)N1C=CC=CC1- InChIKey
HNCCQMYKBLNGNU-UHFFFAOYSA-N- Molecular formula
- C9H13NO
- Average molar mass
- 151.21 g/mol
- Monoisotopic mass
- 151.09971404
Names & identifiers
- Preferred name
- Pyridine, 1,2-dihydro-1-(1-oxobutyl)-
- IUPAC
- 1-(2H-pyridin-1-yl)butan-1-one
Names & synonyms
849947-72-4Pyridine, 1,2-dihydro-1-(1-oxobutyl)-DTXSID00340397RefChem:376464DTXCID202914781,2-Dihydropyridine, 1-(1-oxobutyl)-HNCCQMYKBLNGNU-UHFFFAOYSA-N1-Butyryl-1,2-dihydropyridine #1-(1-oxobutyl)-1,2-dihydropyridine1-(Pyridin-1(2H)-yl)butan-1-one
Database identifiers
- CAS
849947-72-4- PubChem CID
- 564396
- DTXSID
DTXSID00340397
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 194
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Compound notes
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