Basic information
- CAS
41605-52-1- Standard SMILES
O=S(=O)(Oc1ccc(Cl)cc1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
OWKHRTDJLWTWRF-UHFFFAOYSA-N- Molecular formula
- C10H4ClF9O3S
- Average molar mass
- 410.64 g/mol
- Monoisotopic mass
- 409.9425963
Names & identifiers
- Preferred name
- (4-Chlorophenyl) 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
- IUPAC
- (4-chlorophenyl) 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
Names & synonyms
(4-chlorophenyl) 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate41605-52-1DTXSID60330476RefChem:208680DTXCID20281571NSC263699SCHEMBL31299568OWKHRTDJLWTWRF-UHFFFAOYSA-NNSC-2636994-Chlorophenyl nonafluorobutane-1-sulfonate
Database identifiers
- CAS
41605-52-1- PubChem CID
- 429736
- DTXSID
DTXSID60330476
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 547
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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