Basic information
- CAS
89736-83-4- Standard SMILES
O=c1ccc(C(=Nc2ccccc2)c2ccccc2)c(O)o1- InChIKey
BGFMUYZBFJZVPT-UHFFFAOYSA-N- Molecular formula
- C18H13NO3
- Average molar mass
- 291.3 g/mol
- Monoisotopic mass
- 291.08954328
Names & identifiers
- Preferred name
- 3-[Anilino(phenyl)methylidene]-2H-pyran-2,6(3H)-dione
- IUPAC
- 5-(C,N-diphenylcarbonimidoyl)-6-hydroxypyran-2-one
Names & synonyms
89736-83-43-[Anilino(phenyl)methylidene]-2H-pyran-2,6(3H)-dioneDTXSID50755159
Database identifiers
- CAS
89736-83-4- PubChem CID
- 136270010
- DTXSID
DTXSID50755159
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 506
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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