Basic information
- Standard SMILES
N#Cc1ccc(F)c(C#N)c1Cl- InChIKey
OIOOJIZDOMWYER-UHFFFAOYSA-N- Molecular formula
- C8H2ClFN2
- Average molar mass
- 180.56 g/mol
Names & identifiers
- Preferred name
- 2-Chloro-4-fluoroisophthalonitrile
- IUPAC
- 2-chloro-4-fluorobenzene-1,3-dicarbonitrile
Names & synonyms
2-chloro-4-fluoroisophthalonitrile924626-93-7SCHEMBL3338599OIOOJIZDOMWYER-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 59370516
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 261
Related reactions
4 records
Compound notes
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