Basic information
- Standard SMILES
CCCCCCCCCc1ccc(-c2ccc(B(O)O)c(F)n2)cc1- InChIKey
VAEJXCPPCKAVRG-UHFFFAOYSA-N- Molecular formula
- C20H27BFNO2
- Average molar mass
- 343.2 g/mol
- Monoisotopic mass
- 343.2118874
Names & identifiers
- Preferred name
- 2-Fluoro-6-(4-nonylphenyl)pyridine-3-boronic acid
- IUPAC
- [2-fluoro-6-(4-nonylphenyl)-3-pyridinyl]boronic acid
Names & synonyms
SCHEMBL7111865VAEJXCPPCKAVRG-UHFFFAOYSA-N2-fluoro-6-(4-nonylphenyl)pyridine-3-boronic acid
Database identifiers
- PubChem CID
- 18172828
Properties
Computed structural properties
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 351
Related reactions
3 records
Compound notes
Loading…