| CAS Number | 921160-84-1 |
| Catalog Number | AG01AFCZ |
| Chemical Name | 2-(Pyrrolidine-1-sulfonyl)benzene-1-sulfonyl chloride |
| IUPAC Name | 2-pyrrolidin-1-ylsulfonylbenzenesulfonyl chloride |
| InChI | InChI=1S/C10H12ClNO4S2/c11-17(13,14)9-5-1-2-6-10(9)18(15,16)12-7-3-4-8-12/h1-2,5-6H,3-4,7-8H2 |
| InChI Key | YCLRDOYDJIXCKE-UHFFFAOYSA-N |
| MDL Number | MFCD09814974 |
| Molecular Formula | C10H12ClNO4S2 |
| Molecular Weight | 309.7896 |
| SMILES | ClS(C1=C(S(N2CCCC2)(=O)=O)C=CC=C1)(=O)=O |
| Synonyms | 2-(PYRROLIDINE-1-SULFONYL)BENZENE-1-SULFONYL CHLORIDE,
921160-84-1,
CTK7I2096,
AKOS000166140,
ZINC100500926,
NE37947,
|
| Complexity | 485 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 308.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 309.779g/mol |
| Monoisotopic Mass | 308.99g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 88.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number