| CAS Number | 1781100-57-9 |
| Catalog Number | AG01BVE6 |
| Chemical Name | 2-(4-fluorophenyl)-2-methoxyethane-1-sulfonyl chloride |
| IUPAC Name | 2-(4-fluorophenyl)-2-methoxyethanesulfonyl chloride |
| InChI | InChI=1S/C9H10ClFO3S/c1-14-9(6-15(10,12)13)7-2-4-8(11)5-3-7/h2-5,9H,6H2,1H3 |
| InChI Key | DLJARSQDOLJBOS-UHFFFAOYSA-N |
| MDL Number | MFCD30476355 |
| Molecular Formula | C9H10ClFO3S |
| Molecular Weight | 252.6903 |
| SMILES | COC(C1=CC=C(F)C=C1)CS(Cl)(=O)=O |
| Synonyms | 2-(4-fluorophenyl)-2-methoxyethane-1-sulfonyl chloride,
1781100-57-9,
|
| Complexity | 280 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.002g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 252.684g/mol |
| Monoisotopic Mass | 252.002g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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