Basic information
- Standard SMILES
N#CC(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)CCC(F)(F)F- InChIKey
UTMWQPCTXBVSSB-UHFFFAOYSA-N- Molecular formula
- C11H9F12NO2S
- Average molar mass
- 447.24 g/mol
Names & identifiers
- Preferred name
- 5,5,6,6,7,7,8,8,8-Nonafluoro-2-(3,3,3-trifluoropropylsulfonyl)octanenitrile
- IUPAC
- 5,5,6,6,7,7,8,8,8-nonafluoro-2-(3,3,3-trifluoropropylsulfonyl)octanenitrile
Names & synonyms
SCHEMBL2429761UTMWQPCTXBVSSB-UHFFFAOYSA-N5,5,6,6,7,7,8,8,8-nonafluoro-2-(3,3,3-trifluoropropylsulfonyl)octanenitrile
Database identifiers
- PubChem CID
- 57788352
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 66.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 664
Related reactions
1 records
Compound notes
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