| CAS Number | 1245534-96-6 |
| Catalog Number | AG01AG2I |
| Chemical Name | 5-chloro-2-(cyclopentyloxy)benzene-1-sulfonyl chloride |
| IUPAC Name | 5-chloro-2-cyclopentyloxybenzenesulfonyl chloride |
| InChI | InChI=1S/C11H12Cl2O3S/c12-8-5-6-10(11(7-8)17(13,14)15)16-9-3-1-2-4-9/h5-7,9H,1-4H2 |
| InChI Key | FWCOWACLOWTUDY-UHFFFAOYSA-N |
| MDL Number | MFCD17167975 |
| Molecular Formula | C11H12Cl2O3S |
| Molecular Weight | 295.1822 |
| SMILES | ClC1=CC(S(Cl)(=O)=O)=C(OC2CCCC2)C=C1 |
| Synonyms | 5-chloro-2-(cyclopentyloxy)benzene-1-sulfonyl chloride,
1245534-96-6,
5-Chloro-2-cyclopentyloxy-benzenesulfonyl chloride,
ZINC88270811,
AKOS011385456,
NE55370,
|
| Complexity | 346 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 293.988g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 295.174g/mol |
| Monoisotopic Mass | 293.988g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number