3-Methoxy-3-phenyl-2-benzofuran-1(3H)-one
Basic information
- CAS
7335-63-9- Standard SMILES
COC1(c2ccccc2)OC(=O)c2ccccc21- InChIKey
WWROZRYLEDOUCU-UHFFFAOYSA-N- Molecular formula
- C15H12O3
- Average molar mass
- 240.25 g/mol
- Monoisotopic mass
- 240.07864424
Names & identifiers
- Preferred name
- 3-Methoxy-3-phenyl-2-benzofuran-1(3H)-one
- IUPAC
- 3-methoxy-3-phenyl-2-benzofuran-1-one
Names & synonyms
7335-63-93-Methoxy-3-phenyl-2-benzofuran-1(3H)-one3-methoxy-3-phenyl-2-benzofuran-1-one3-Methoxy-3-phenyl-3H-isobenzofuran-1-one3-Methoxy-3-phenylisobenzofuran-1(3H)-oneNSC59311NSC 59311Oprea1_239806Oprea1_363170SCHEMBL10745566NSC-59311STL168852
Show more names
AKOS000621425AKOS0220229343-methoxy-3-phenyl-isobenzofuran-1-oneST45138846ST502449553-methoxy-3-phenyl-3-hydroisobenzofuran-1-oneAK-968/36802042
Database identifiers
- CAS
7335-63-9- PubChem CID
- 246358
- Nikkaji
- J343.989E
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 322
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Compound notes
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