| CAS Number | 1188525-46-3 |
| Catalog Number | AG019WFS |
| Chemical Name | 4-Fluoro-3-methanesulfonylbenzene-1-sulfonyl chloride |
| IUPAC Name | 4-fluoro-3-methylsulfonylbenzenesulfonyl chloride |
| InChI | InChI=1S/C7H6ClFO4S2/c1-14(10,11)7-4-5(15(8,12)13)2-3-6(7)9/h2-4H,1H3 |
| InChI Key | RLXOANSRXCHLPD-UHFFFAOYSA-N |
| MDL Number | MFCD12913017 |
| Molecular Formula | C7H6ClFO4S2 |
| Molecular Weight | 272.7015 |
| SMILES | CS(C1=C(F)C=CC(S(Cl)(=O)=O)=C1)(=O)=O |
| Synonyms | 4-fluoro-3-methanesulfonylbenzene-1-sulfonyl chloride,
1188525-46-3,
AC1Q4GG8,
SCHEMBL14121088,
CTK7C1308,
ZINC100588814,
NE15629,
EN300-51814,
|
| Complexity | 419 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.938g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 272.689g/mol |
| Monoisotopic Mass | 271.938g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 85A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
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Certificate of Analysis
Lot Number