| CAS Number | 137049-01-5 |
| Catalog Number | AG019TO5(AGN-PC-003R1B) |
| Chemical Name | 1-Ethyl-1H-imidazole-4-sulfonyl chloride |
| IUPAC Name | 1-ethylimidazole-4-sulfonyl chloride |
| InChI | InChI=1S/C5H7ClN2O2S/c1-2-8-3-5(7-4-8)11(6,9)10/h3-4H,2H2,1H3 |
| InChI Key | JIEHZRJEPGJDMI-UHFFFAOYSA-N |
| MDL Number | MFCD19662430 |
| Molecular Formula | C5H7ClN2O2S |
| Molecular Weight | 194.6393 |
| SMILES | CCN1C=C(S(Cl)(=O)=O)N=C1 |
| Synonyms | 1-ethyl-1H-imidazole-4-sulfonyl chloride,
137049-01-5,
SCHEMBL9032448,
JIEHZRJEPGJDMI-UHFFFAOYSA-N,
1-ethyl-4-imidazolesulfonyl chloride,
ZINC59027442,
AKOS013462162,
MCULE-5637258344,
NE43982,
FT-0766110,
F2158-1669,
|
| Complexity | 223 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.992g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.633g/mol |
| Monoisotopic Mass | 193.992g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 60.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number