Basic information
- Standard SMILES
N#Cc1cccc(C#Cc2cncc(Cl)c2)c1- InChIKey
FICZNQYOYAFNKE-UHFFFAOYSA-N- Molecular formula
- C14H7ClN2
- Average molar mass
- 238.67 g/mol
Names & identifiers
- Preferred name
- 3-(5-Chloropyridin-3-ylethynyl)-benzonitrile
- IUPAC
- 3-[2-(5-chloro-3-pyridinyl)ethynyl]benzonitrile
Names & synonyms
SCHEMBL1477330FICZNQYOYAFNKE-UHFFFAOYSA-N3-(5-Chloropyridin-3-ylethynyl)-benzonitrile
Database identifiers
- PubChem CID
- 67047769
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 36.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 369
Related reactions
2 records
Compound notes
Loading…