Basic information
- Standard SMILES
C=Cc1ccc(C(C)=O)cn1- InChIKey
PLIBXFMFBAMJME-UHFFFAOYSA-N- Molecular formula
- C9H9NO
- Average molar mass
- 147.17 g/mol
- Monoisotopic mass
- 147.06841391
Names & identifiers
- Preferred name
- 1-(6-Vinylpyridin-3-YL)ethanone
- IUPAC
- 1-(6-ethenyl-3-pyridinyl)ethanone
Names & synonyms
1-(6-VINYLPYRIDIN-3-YL)ETHANONE1259929-69-51-(6-ethenylpyridin-3-yl)ethan-1-oneSCHEMBL932013SCHEMBL31003291DTXSID10732547PLIBXFMFBAMJME-UHFFFAOYSA-NSB54583DB-336835
Database identifiers
- CAS
1259929-69-5- PubChem CID
- 59636720
- DTXSID
DTXSID10732547
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 30 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 165
Related reactions
5 records
Linked notes
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