(R)-2-(2-Bromophenyl)-4-phenyl-4,5-dihydrooxazole
Basic information
- CAS
191330-82-2- Standard SMILES
Brc1ccccc1C1=N[C@H](c2ccccc2)CO1- InChIKey
VHKCPSPWIFJAKI-AWEZNQCLSA-N- Molecular formula
- C15H12BrNO
- Average molar mass
- 302.16 g/mol
- Monoisotopic mass
- 301.01023
Names & identifiers
- Preferred name
- (R)-2-(2-Bromophenyl)-4-phenyl-4,5-dihydrooxazole
- IUPAC
- (4R)-2-(2-bromophenyl)-4-phenyl-4,5-dihydro-1,3-oxazole
- English name
- (R)-2-(2-Bromophenyl)-4-phenyl-4,5-dihydrooxazole
- Molecular formula
- C15H12BrNO
- Molecular weight
- 302.17
Names & synonyms
191330-82-2(R)-2-(2-BROMOPHENYL)-4-PHENYL-4,5-DIHYDROOXAZOLE(4R)-2-(2-BROMOPHENYL)-4-PHENYL-4,5-DIHYDRO-1,3-OXAZOLECTK4E0628DTXSID20461391MFCD08234766BS-50845F73115F863388(4R)-2-(2-bromophenyl)-4-phenyl-4,5-dihydrooxazoleOxazole, 2-(2-bromophenyl)-4,5-dihydro-4-phenyl-, (4R)-
Database identifiers
- CAS
191330-82-2- PubChem CID
- 11289623
- DTXSID
DTXSID20461391- Nikkaji
- J1.486.728G
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 21.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 312
Physicochemical properties
- Boiling point
- 422.2 · 422.2±45.0 °C(Predicted)
- Density
- 1.42 · 1.42±0.1 g/cm3(Predicted)
- pka
- 3.07 · 3.07±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
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
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…