Basic information
- Standard SMILES
CC1(C)COB(c2cc(F)cc(-c3cccnc3)c2)OC1- InChIKey
BFRYNIQGXFZPNK-UHFFFAOYSA-N- Molecular formula
- C16H17BFNO2
- Average molar mass
- 285.1 g/mol
- Monoisotopic mass
- 285.1336371
Names & identifiers
- Preferred name
- 3-[3-(5,5-Dimethyl[1,3,2]dioxaborinan-2-yl)-5-fluorophenyl]pyridine
- IUPAC
- 3-[3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-5-fluorophenyl]pyridine
Names & synonyms
SCHEMBL2650049BFRYNIQGXFZPNK-UHFFFAOYSA-N3-[3-(5,5-dimethyl[1,3,2]dioxaborinan-2-yl)-5-fluorophenyl]pyridine
Database identifiers
- PubChem CID
- 22285272
Properties
Computed structural properties
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 345
Related reactions
2 records
Compound notes
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