(3-(2,6-Diphenylpyridin-4-yl)phenyl)boronic acid
Basic information
- CAS
2396739-36-7- Standard SMILES
OB(O)c1cccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)c1- InChIKey
JTTXINQDTKZQPH-UHFFFAOYSA-N- Molecular formula
- C23H18BNO2
- Average molar mass
- 351.2 g/mol
Names & identifiers
- Preferred name
- (3-(2,6-Diphenylpyridin-4-yl)phenyl)boronic acid
- IUPAC
- [3-(2,6-diphenyl-4-pyridinyl)phenyl]boronic acid
- English name
- (3-(4,6-diphenylpyridin-2-yl)phenyl)boronic acid
- Molecular formula
- C23H18BNO2
- Molecular weight
- 351.21
Names & synonyms
(3-(2,6-diphenylpyridin-4-yl)phenyl)boronic acid2396739-36-7SCHEMBL25582486H62233(3-(4,6-diphenylpyridin-2-yl)phenyl)boronic acidBoronic acid, B-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-
Database identifiers
- CAS
2396739-36-7
Properties
Computed structural properties
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 422
Physicochemical properties
- Boiling point
- 567.4 · 567.4±52.0 °C(Predicted)
- Density
- 1.26 · 1.26±0.1 g/cm3(Predicted)
- pka
- 7.79 · 7.79±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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