| CAS Number | 1340283-38-6 |
| Catalog Number | AG00J2O5(AGN-PC-0WB61W) |
| Chemical Name | 1-propyl-1H-pyrazole-5-sulfonyl chloride |
| IUPAC Name | 2-propylpyrazole-3-sulfonyl chloride |
| InChI | InChI=1S/C6H9ClN2O2S/c1-2-5-9-6(3-4-8-9)12(7,10)11/h3-4H,2,5H2,1H3 |
| InChI Key | WNFNBNMOQMUQGU-UHFFFAOYSA-N |
| MDL Number | MFCD19621605 |
| Molecular Formula | C6H9ClN2O2S |
| Molecular Weight | 208.6659 |
| SMILES | C1(=CC=NN1CCC)S(Cl)(=O)=O |
| Synonyms | 1-propyl-1H-pyrazole-5-sulfonyl chloride,
1340283-38-6,
MFCD19621605,
AKOS013290691,
ZINC100294776,
Y-8091,
1-Propyl-1H-pyrazole-5-sulfonyl chloride, AldrichCPR,
|
| Complexity | 236 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.007g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.66g/mol |
| Monoisotopic Mass | 208.007g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 60.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number