(4S,5S)-4,5-Diphenyl-2-(6-phenylpyridin-2-yl)-4,5-dihydrooxazole
Basic information
- CAS
2757082-57-6- Standard SMILES
c1ccc(-c2cccc(C3=N[C@@H](c4ccccc4)[C@H](c4ccccc4)O3)n2)cc1- InChIKey
GEGIOXAHQGYSFZ-DQEYMECFSA-N- Molecular formula
- C26H20N2O
- Average molar mass
- 376.4 g/mol
Names & identifiers
- Preferred name
- (4S,5S)-4,5-Diphenyl-2-(6-phenylpyridin-2-yl)-4,5-dihydrooxazole
- IUPAC
- (4S,5S)-4,5-diphenyl-2-(6-phenyl-2-pyridinyl)-4,5-dihydro-1,3-oxazole
- English name
- Pyridine, 2-[(4S,5S)-4,5-dihydro-4,5-diphenyl-2-oxazolyl]-6-phenyl-
- Molecular formula
- C26H20N2O
- Molecular weight
- 376.45
Names & synonyms
(4S,5S)-4,5-Diphenyl-2-(6-phenylpyridin-2-yl)-4,5-dihydrooxazole2757082-57-6(4S,5S)-4,5-diphenyl-2-(6-phenylpyridin-2-yl)-4,5-dihydro-1,3-oxazoleC26H20N2OMFCD34563659BS-49153F741092-[(4S,5S)-4,5-Dihydro-4,5-diphenyl-2-oxazolyl]-6-phenylpyridinePyridine, 2-[(4S,5S)-4,5-dihydro-4,5-diphenyl-2-oxazolyl]-6-phenyl-
Database identifiers
- CAS
2757082-57-6
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 34.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 543
Physicochemical properties
- Boiling point
- 571.5 · 571.5±50.0 °C(Predicted)
- Density
- 1.16 · 1.16±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, stored under nitrogen
- pka
- 2.41 · 2.41±0.70(Predicted)
- Appearance
- White to off-white Solid
- optical activity
- 7.833 ° · 7.833° (C=0.11 DCM)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-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
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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