1,2,4-Oxadiazole, 3,5-diphenyl-, 4-oxide
Basic information
- CAS
20594-92-7- Standard SMILES
[O-][n+]1c(-c2ccccc2)noc1-c1ccccc1- InChIKey
DUFTVORLLGQZQC-UHFFFAOYSA-N- Molecular formula
- C14H10N2O2
- Average molar mass
- 238.24 g/mol
- Monoisotopic mass
- 238.07422757
Names & identifiers
- Preferred name
- 1,2,4-Oxadiazole, 3,5-diphenyl-, 4-oxide
- IUPAC
- 4-oxido-3,5-diphenyl-1,2,4-oxadiazol-4-ium
Names & synonyms
1,2,4-Oxadiazole, 3,5-diphenyl-, 4-oxide20594-92-7DTXSID30341054RefChem:214934DTXCID502921353,5-diphenyl-1 ,2,4-oxadiazole-4-oxide4-Oxo-3,5-diphenyl-1,2,4lambda~5~-oxadiazole
Database identifiers
- CAS
20594-92-7- PubChem CID
- 569601
- DTXSID
DTXSID30341054- Nikkaji
- J1.280.728G
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 51.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 263
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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