| CAS Number | 82875-86-3 |
| Catalog Number | AG00G4MJ(AGN-PC-00K6PK) |
| Chemical Name | 2-Chloro-5-fluorobenzene-1-sulfonyl chloride |
| IUPAC Name | 2-chloro-5-fluorobenzenesulfonyl chloride |
| InChI | InChI=1S/C6H3Cl2FO2S/c7-5-2-1-4(9)3-6(5)12(8,10)11/h1-3H |
| InChI Key | IKUKZLDGZFXXNE-UHFFFAOYSA-N |
| MDL Number | MFCD12026156 |
| Molecular Formula | C6H3Cl2FO2S |
| Molecular Weight | 229.0562 |
| SMILES | ClC1=C(C=C(C=C1)F)S(=O)(=O)Cl |
| Synonyms | 82875-86-3,
2-chloro-5-fluorobenzene-1-sulfonyl chloride,
2-Chloro-5-fluorobenzenesulfonyl chloride,
AC1Q4LIF,
SCHEMBL1060711,
DTXSID90513558,
IKUKZLDGZFXXNE-UHFFFAOYSA-N,
GEO-04129,
AKOS012475214,
ZINC100507941,
NE15374,
Benzenesulfonyl chloride, 2-chloro-5-fluoro-,
EN300-68769,
|
| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.921g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.046g/mol |
| Monoisotopic Mass | 227.921g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number