3,3-Bis(ethylsulfonyl)pentane
TL;DR: 3,3-Bis(ethylsulfonyl)pentane (CAS 2217-59-6) is a chemical compound with molecular formula C9H20O4S2 and molecular weight 256.0803 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,3-bis(ethylsulfonyl)pentane
Also Known As: Tetronal, 3,3-Bis(ethylsulfonyl)pentane, Sulfonyldiethylmethane, Sulfondiethylmethane, Pentane-3,3-diethylsulfone
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H20O4S2 |
| Molecular Weight | 256.0803 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 85.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 256.0803 Da |
| Heavy Atoms | 15 |
| Complexity | 341.0 |
| SMILES | CCC(CC)(S(=O)(=O)CC)S(=O)(=O)CC |
| InChIKey | VTZYVPLHCQBWSP-UHFFFAOYSA-N |
Chemical Property Profile of 3,3-Bis(ethylsulfonyl)pentane
Property Insights of 3,3-Bis(ethylsulfonyl)pentane
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Bis(ethylsulfonyl)pentane. The TPSA of 85.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3-Bis(ethylsulfonyl)pentane. Following Lipinski's Rule of Five, 3,3-Bis(ethylsulfonyl)pentane has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,3-Bis(ethylsulfonyl)pentane?
The CAS number of 3,3-Bis(ethylsulfonyl)pentane is 2217-59-6.
What is the molecular formula of 3,3-Bis(ethylsulfonyl)pentane?
The molecular formula of 3,3-Bis(ethylsulfonyl)pentane is C9H20O4S2.
What is the molecular weight of 3,3-Bis(ethylsulfonyl)pentane?
The molecular weight of 3,3-Bis(ethylsulfonyl)pentane is 256.0803 g/mol.
Where can I buy 3,3-Bis(ethylsulfonyl)pentane?
You can request a quote for 3,3-Bis(ethylsulfonyl)pentane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,3-Bis(ethylsulfonyl)pentane?
Yes, CoreyChem provides custom synthesis services for 3,3-Bis(ethylsulfonyl)pentane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.