3-Chloro-4-((triphenylphosphoranyl)methyl)benzenesulfonyl fluoride
Basic information
- CAS
31362-37-5- Standard SMILES
O=S(=O)(F)c1ccc(C[P+](c2ccccc2)(c2ccccc2)c2ccccc2)c(Cl)c1- InChIKey
XWXRVSOVPRJNQR-UHFFFAOYSA-N- Molecular formula
- C25H20ClFO2PS+
- Average molar mass
- 469.9 g/mol
- Monoisotopic mass
- 469.0594189
Names & identifiers
- Preferred name
- 3-Chloro-4-((triphenylphosphoranyl)methyl)benzenesulfonyl fluoride
- IUPAC
- (2-chloro-4-fluorosulfonylphenyl)methyl-triphenylphosphanium
Names & synonyms
31362-37-53-Chloro-4-((triphenylphosphoranyl)methyl)benzenesulfonyl fluorideNSC 138273NSC138273DTXSID60185281(2-chloro-4-fluorosulfonyl-phenyl)methyl-triphenyl-phosphonium{[2-Chloro-4-(fluorosulfonyl)phenyl]methyl}tri(phenyl)phosphanium
Database identifiers
- CAS
31362-37-5- PubChem CID
- 494141
- DTXSID
DTXSID60185281
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 1
- Complexity
- 618
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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