| CAS Number | 1310730-52-9 |
| Catalog Number | AG01B2J5 |
| Chemical Name | 1-Ethylcyclopropane-1-sulfonyl chloride |
| IUPAC Name | 1-ethylcyclopropane-1-sulfonyl chloride |
| InChI | InChI=1S/C5H9ClO2S/c1-2-5(3-4-5)9(6,7)8/h2-4H2,1H3 |
| InChI Key | QNGQHQVBGKAXOY-UHFFFAOYSA-N |
| MDL Number | MFCD22394388 |
| Molecular Formula | C5H9ClO2S |
| Molecular Weight | 168.6418 |
| SMILES | CCC1(S(Cl)(=O)=O)CC1 |
| Synonyms | 1-ethylcyclopropane-1-sulfonyl chloride,
1310730-52-9,
Cyclopropanesulfonylchloride,1-ethyl-,
SCHEMBL1933568,
QNGQHQVBGKAXOY-UHFFFAOYSA-N,
ZINC103860379,
|
| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.635g/mol |
| Monoisotopic Mass | 168.001g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number