Basic information
- Standard SMILES
C(=CC1OCCO1)c1ccc(-c2ccccn2)cc1- InChIKey
VRXJNAHCQHENGF-UHFFFAOYSA-N- Molecular formula
- C16H15NO2
- Average molar mass
- 253.29 g/mol
- Monoisotopic mass
- 253.11027872
Names & identifiers
- Preferred name
- 2-{4-[2-(1,3-Dioxolan-2-yl)vinyl]-phenyl)pyridine
- IUPAC
- 2-[4-[2-(1,3-dioxolan-2-yl)ethenyl]phenyl]pyridine
Names & synonyms
SCHEMBL3516331VRXJNAHCQHENGF-UHFFFAOYSA-N2-{4-[2-(1,3-dioxolan-2-yl)vinyl]-phenyl)pyridine
Database identifiers
- PubChem CID
- 68673097
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 291
Related reactions
2 records
Compound notes
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