Basic information
- CAS
5667-25-4- Standard SMILES
O=C1OC(c2ccccc2)=NC1=Cc1ccc([N+](=O)[O-])o1- InChIKey
WCBGXIFIOVRXGJ-UHFFFAOYSA-N- Molecular formula
- C14H8N2O5
- Average molar mass
- 284.22 g/mol
- Monoisotopic mass
- 284.04332136
Names & identifiers
- Preferred name
- 4-[(5-Nitrofuran-2-yl)methylidene]-2-phenyl-1,3-oxazol-5-one
- IUPAC
- 4-[(5-nitrofuran-2-yl)methylidene]-2-phenyl-1,3-oxazol-5-one
Names & synonyms
5667-25-4138579-62-1DTXSID209721144-[(5-Nitrofuran-2-yl)methylidene]-2-phenyl-1,3-oxazol-5(4H)-one
Database identifiers
- CAS
5667-25-4- PubChem CID
- 825596
- DTXSID
DTXSID20972114
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 97.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 502
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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