| CAS Number | 815576-24-0 |
| Catalog Number | AG01AGVF |
| Chemical Name | 4-(3-chlorophenoxy)benzene-1-sulfonyl chloride |
| IUPAC Name | 4-(3-chlorophenoxy)benzenesulfonyl chloride |
| InChI | InChI=1S/C12H8Cl2O3S/c13-9-2-1-3-11(8-9)17-10-4-6-12(7-5-10)18(14,15)16/h1-8H |
| InChI Key | JNMIOFCTTBBMJG-UHFFFAOYSA-N |
| MDL Number | MFCD09809027 |
| Molecular Formula | C12H8Cl2O3S |
| Molecular Weight | 303.1611 |
| SMILES | ClC1=CC(OC2=CC=C(S(Cl)(=O)=O)C=C2)=CC=C1 |
| Synonyms | 4-(3-chlorophenoxy)benzene-1-sulfonyl chloride,
815576-24-0,
AC1Q3IGJ,
CTK6H2852,
AKOS000165760,
ZINC100601184,
NE31421,
EN300-72956,
|
| Complexity | 358 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 301.957g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 303.153g/mol |
| Monoisotopic Mass | 301.957g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number