Isoxazole, 5-(4-bromophenyl)-3-phenyl-
Basic information
- CAS
53573-22-1- Standard SMILES
Brc1ccc(-c2cc(-c3ccccc3)no2)cc1- InChIKey
ZOBQWQDCDGXWAE-UHFFFAOYSA-N- Molecular formula
- C15H10BrNO
- Average molar mass
- 300.15 g/mol
- Monoisotopic mass
- 298.99458
Names & identifiers
- Preferred name
- Isoxazole, 5-(4-bromophenyl)-3-phenyl-
- IUPAC
- 5-(4-bromophenyl)-3-phenyl-1,2-oxazole
Names & synonyms
53573-22-1Isoxazole, 5-(4-bromophenyl)-3-phenyl-DTXSID20356874RefChem:350246DTXCID303079335-(4-Bromophenyl)-3-phenylisoxazole5-(4-bromophenyl)-3-phenyl-1,2-oxazoleSCHEMBL28662125HMS1674G08STL582622AKOS000560391ST50000282
Database identifiers
- CAS
53573-22-1- PubChem CID
- 835944
- DTXSID
DTXSID20356874- Nikkaji
- J1.932.380C
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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