| CAS Number | 1249353-51-2 |
| Catalog Number | AG01AIAD(AGN-PC-0WO5RI) |
| Chemical Name | 1-Methoxypropane-2-sulfonyl chloride |
| IUPAC Name | 1-methoxypropane-2-sulfonyl chloride |
| InChI | InChI=1S/C4H9ClO3S/c1-4(3-8-2)9(5,6)7/h4H,3H2,1-2H3 |
| InChI Key | ZKHNHOVTIDJLGB-UHFFFAOYSA-N |
| MDL Number | MFCD16788631 |
| Molecular Formula | C4H9ClO3S |
| Molecular Weight | 172.6305 |
| SMILES | COCC(S(Cl)(=O)=O)C |
| Synonyms | 1-methoxypropane-2-sulfonyl chloride,
1249353-51-2,
SCHEMBL17511352,
AKOS011825413,
NE16093,
EN300-77178,
1-Methoxypropane-2-sulfonyl chloride, AldrichCPR,
|
| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.996g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.623g/mol |
| Monoisotopic Mass | 171.996g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number