Basic information
- CAS
65869-72-9- Standard SMILES
O=c1c(-c2ccccc2)cc2c(-c3ccccc3)oc(-c3ccccc3)c2cc1-c1ccccc1- InChIKey
AXPWBHQBQVJOKP-UHFFFAOYSA-N- Molecular formula
- C33H22O2
- Average molar mass
- 450.5 g/mol
- Monoisotopic mass
- 450.16197994
Names & identifiers
- Preferred name
- 1,3,5,7-Tetraphenyl-6H-cyclohepta[c]furan-6-one
- IUPAC
- 1,3,5,7-tetraphenylcyclohepta[c]furan-6-one
Names & synonyms
65869-72-9NSC3055231,3,5,7-Tetraphenyl-6H-cyclohepta[c]furan-6-oneDTXSID60316674NSC-305523
Database identifiers
- CAS
65869-72-9- PubChem CID
- 328084
- DTXSID
DTXSID60316674
Properties
Computed structural properties
- XLogP
- 8.1
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 720
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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