TL;DR: Sulfonium, dimethyl(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, perchlorate (CAS 110826-52-3) is a chemical compound with molecular formula C10H16ClNO5S and molecular weight 297.04376 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-[4-(2-oxopyrrolidin-1-yl)but-2-ynyl]sulfanium perchlorate
Also Known As: Sulfonium, dimethyl(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, perchlorate, (4-(2-Oxopyrrolidinyl)-2-butynyl)dimethylsulfonium perchlorate, dimethyl-[4-(2-oxopyrrolidin-1-yl)but-2-ynyl]sulfanium perchlorate, dimethyl-[4-(2-oxopyrrolidin-1-yl)but-2-ynyl]sulfanium,perchlorate, Sulfonium,dimethyl(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-,perchlorate
| Molecular Formula | C10H16ClNO5S |
| Molecular Weight | 297.04376 g/mol |
| XLogP | -4.2659 |
| Topological Polar Surface Area (TPSA) | 95.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.04376 Da |
| Heavy Atoms | 18 |
| Complexity | 344.0 |
| SMILES | C[S+](C)CC#CCN1CCCC1=O.[O-]Cl(=O)(=O)=O |
| InChIKey | LXTQNTCIXNHFJL-UHFFFAOYSA-M |
The XLogP value of -4.2659 indicates that Sulfonium, dimethyl(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, perchlorate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulfonium, dimethyl(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, perchlorate. Following Lipinski's Rule of Five, Sulfonium, dimethyl(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, perchlorate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Sulfonium, dimethyl(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, perchlorate is 110826-52-3.
The molecular formula of Sulfonium, dimethyl(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, perchlorate is C10H16ClNO5S.
The molecular weight of Sulfonium, dimethyl(4-(2-oxo-1-pyrrolidinyl)-2-butynyl)-, perchlorate is 297.04376 g/mol.
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