| CAS Number | 1909337-37-6 |
| Catalog Number | AG01C400 |
| Chemical Name | 4-(5-chloropentanamido)benzene-1-sulfonyl chloride |
| IUPAC Name | 4-(5-chloropentanoylamino)benzenesulfonyl chloride |
| InChI | InChI=1S/C11H13Cl2NO3S/c12-8-2-1-3-11(15)14-9-4-6-10(7-5-9)18(13,16)17/h4-7H,1-3,8H2,(H,14,15) |
| InChI Key | YKWUQUHDCHPGLZ-UHFFFAOYSA-N |
| MDL Number | MFCD29762951 |
| Molecular Formula | C11H13Cl2NO3S |
| Molecular Weight | 310.1968 |
| SMILES | ClCCCCC(NC1=CC=C(S(Cl)(=O)=O)C=C1)=O |
| Synonyms | 4-(5-chloropentanamido)benzene-1-sulfonyl chloride,
1909337-37-6,
ZINC328579723,
|
| Complexity | 359 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 308.999g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 310.189g/mol |
| Monoisotopic Mass | 308.999g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 71.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number