2-[4-(Benzyloxy)phenyl]benzo-1,4-quinone
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Basic information
- CAS
496875-25-3- Standard SMILES
O=C1C=CC(=O)C(c2ccc(OCc3ccccc3)cc2)=C1- InChIKey
PUSULFBNGHQGSK-UHFFFAOYSA-N- Molecular formula
- C19H14O3
- Average molar mass
- 290.3 g/mol
- Monoisotopic mass
- 290.0942943
Names & identifiers
- Preferred name
- 2-[4-(Benzyloxy)phenyl]benzo-1,4-quinone
- IUPAC
- 2-(4-phenylmethoxyphenyl)cyclohexa-2,5-diene-1,4-dione
- English name
- 2-[4-(benzyloxy)phenyl]benzo-1,4-quinone
- Molecular formula
- C19H14O3
- Molecular weight
- 290.31266
Names & synonyms
2-[4-(benzyloxy)phenyl]benzo-1,4-quinone2-(4-phenylmethoxyphenyl)cyclohexa-2,5-diene-1,4-dioneAN-970/40920625
Database identifiers
- CAS
496875-25-3- PubChem CID
- 839301
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 475
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