| CAS Number | 565-23-1 |
| Catalog Number | AG01FOK7(AGN-PC-0OCDXV) |
| Chemical Name | 1-chloro-4-[(4-fluorophenyl)sulfonyl]benzene |
| IUPAC Name | 1-(4-chlorophenyl)sulfonyl-4-fluorobenzene |
| InChI | InChI=1S/C12H8ClFO2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H |
| InChI Key | URPIOHXFOXUKJB-UHFFFAOYSA-N |
| MDL Number | MFCD00018657 |
| Molecular Formula | C12H8ClFO2S |
| Molecular Weight | 270.7071 |
| SMILES | Fc1ccc(cc1)S(=O)(=O)c1ccc(cc1)Cl |
| Synonyms | 565-23-1,
Benzene, 1-chloro-4-[(4-fluorophenyl)sulfonyl]-,
AC1LFZJ0,
SCHEMBL809256,
CTK1E1828,
DTXSID60354899,
ZINC283715,
4-Chloro-4'-fluorodiphenyl sulfone,
AKOS003630954,
MCULE-3381029835,
1-(4-chlorophenyl)sulfonyl-4-fluorobenzene,
4-CHLOROPHENYL 4-FLUOROPHENYL SULFONE,
1-Chloro-4-((4-fluorophenyl)sulfonyl)benzene,
CID786373,
ZINC00283715,
4-Chlorophenyl 4'-fluorophenyl sulfone,
|
| Complexity | 336 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.992g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.702g/mol |
| Monoisotopic Mass | 269.992g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number