TL;DR: 1-Propanesulfonyl chloride (CAS 10147-36-1) is a chemical compound with molecular formula C3H7ClO2S and molecular weight 141.98553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
propane-1-sulfonyl chloride
Also Known As: 1-Propanesulfonyl chloride, Propane-1-sulfonyl chloride, Propanesulfonyl chloride, Propanesulphonyl chloride, chloropropylsulfone
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C3H7ClO2S |
| Molecular Weight | 141.98553 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 141.98553 Da |
| Heavy Atoms | 7 |
| Complexity | 120.0 |
| SMILES | CCCS(=O)(=O)Cl |
| InChIKey | KPBSJEBFALFJTO-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanesulfonyl chloride. With a topological polar surface area (TPSA) of 42.5 Ų, 1-Propanesulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanesulfonyl chloride has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Propanesulfonyl chloride is 10147-36-1.
The molecular formula of 1-Propanesulfonyl chloride is C3H7ClO2S.
The molecular weight of 1-Propanesulfonyl chloride is 141.98553 g/mol.
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