Basic information
- CAS
53774-95-1- Standard SMILES
CCOC(c1ccccc1F)C1CCCCCC(Cc2ccccc2F)C1=O- InChIKey
JJKXTVAWLDDWCG-UHFFFAOYSA-N- Molecular formula
- C24H28F2O2
- Average molar mass
- 386.5 g/mol
- Monoisotopic mass
- 386.20573646
Names & identifiers
- Preferred name
- 2-(Ethoxy(2-fluorophenyl)methyl)-8-((2-fluorophenyl)methyl)cyclooctanone
- IUPAC
- 2-[ethoxy-(2-fluorophenyl)methyl]-8-[(2-fluorophenyl)methyl]cyclooctan-1-one
Names & synonyms
53774-95-12-(2-Fluorobenzyl)-8-(alpha-ethoxy-2-flurobenzyl)cyclooctanone2-(Ethoxy(2-fluorophenyl)methyl)-8-((2-fluorophenyl)methyl)cyclooctanoneDTXSID40968554Cyclooctanone, 2-(ethoxy(2-fluorophenyl)methyl)-8-((2-fluorophenyl)methyl)-2-[Ethoxy(2-fluorophenyl)methyl]-8-[(2-fluorophenyl)methyl]cyclooctan-1-one
Database identifiers
- CAS
53774-95-1- PubChem CID
- 3045394
- DTXSID
DTXSID40968554
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 483
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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