Basic information
- CAS
17023-28-8- Standard SMILES
O=c1oc(-c2ccccc2)c2ccccc2c1-c1ccccc1- InChIKey
GEDNDAODOXDFEY-UHFFFAOYSA-N- Molecular formula
- C21H14O2
- Average molar mass
- 298.3 g/mol
- Monoisotopic mass
- 298.09937969
Names & identifiers
- Preferred name
- 1,4-Diphenyl-3H-2-benzopyran-3-one
- IUPAC
- 1,4-diphenylisochromen-3-one
Names & synonyms
DTXSID406483441,4-Diphenyl-3H-2-benzopyran-3-one17023-28-8RefChem:220811DTXCID905990941,4-diphenyl-3H-isochromen-3-one1,4-diphenyl-isochromen-3-oneSCHEMBL11926764
Database identifiers
- CAS
17023-28-8- PubChem CID
- 24978281
- DTXSID
DTXSID40648344
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 606
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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