2-[(2-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2-methylbenzoate
Basic information
- CAS
7047-86-1- Standard SMILES
Cc1ccccc1C(=O)Oc1ccc2c(c1)OC(=Cc1ccccc1F)C2=O- InChIKey
YZVPYWCRWOLGSB-UHFFFAOYSA-N- Molecular formula
- C23H15FO4
- Average molar mass
- 374.4 g/mol
- Monoisotopic mass
- 374.09543712
Names & identifiers
- Preferred name
- 2-[(2-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2-methylbenzoate
- IUPAC
- [2-[(2-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 2-methylbenzoate
Names & synonyms
7047-86-1DTXSID204143072-[(2-Fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2-methylbenzoate
Database identifiers
- CAS
7047-86-1- PubChem CID
- 5264263
- DTXSID
DTXSID20414307
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 630
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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