| CAS Number | 1249441-42-6 |
| Catalog Number | AG019T7G(AGN-PC-0WO99G) |
| Chemical Name | 2-(Propan-2-yloxy)ethane-1-sulfonyl chloride |
| IUPAC Name | 2-propan-2-yloxyethanesulfonyl chloride |
| InChI | InChI=1S/C5H11ClO3S/c1-5(2)9-3-4-10(6,7)8/h5H,3-4H2,1-2H3 |
| InChI Key | MQUXPIRDIANXNY-UHFFFAOYSA-N |
| MDL Number | MFCD14676909 |
| Molecular Formula | C5H11ClO3S |
| Molecular Weight | 186.6570 |
| SMILES | CC(OCCS(Cl)(=O)=O)C |
| Synonyms | 2-(propan-2-yloxy)ethane-1-sulfonyl chloride,
1249441-42-6,
2-Isopropoxyethanesulfonyl chloride,
AKOS010746220,
ZINC100653180,
NE29435,
2-Isopropoxy-ethanesulfonyl chloride,
|
| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.012g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.65g/mol |
| Monoisotopic Mass | 186.012g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number