1-(9h-Fluoren-2-yl)-3-(hexadecylsulfanyl)pyrrolidine-2,5-dione
Basic information
- CAS
5451-46-7- Standard SMILES
CCCCCCCCCCCCCCCCSC1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1=O- InChIKey
JHXDASCIBDLXBS-UHFFFAOYSA-N- Molecular formula
- C33H45NO2S
- Average molar mass
- 519.8 g/mol
- Monoisotopic mass
- 519.31710085
Names & identifiers
- Preferred name
- 1-(9h-Fluoren-2-yl)-3-(hexadecylsulfanyl)pyrrolidine-2,5-dione
- IUPAC
- 1-(9H-fluoren-2-yl)-3-hexadecylsulfanylpyrrolidine-2,5-dione
Names & synonyms
5451-46-71-(9h-fluoren-2-yl)-3-(hexadecylsulfanyl)pyrrolidine-2,5-dioneNSC18447DTXSID60280740NSC 18447NSC-18447
Database identifiers
- CAS
5451-46-7- PubChem CID
- 227146
- DTXSID
DTXSID60280740
Properties
Computed structural properties
- XLogP
- 10.9
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 17
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 696
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Compound notes
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