Di(propylsulfonyl)ethene
TL;DR: Di(propylsulfonyl)ethene (CAS 1113-14-0) is a chemical compound with molecular formula C8H16O4S2 and molecular weight 240.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-propylsulfonylethenylsulfonyl)propane
Also Known As: Chemagro B 1843, di(propylsulfonyl)ethene, NCI60_028860, 1-(2-propylsulfonylethenylsulfonyl)propane, Propane,1,1'-[(1E)-1,2-ethenediylbis(sulfonyl)]bis- (9CI)
| Molecular Formula | C8H16O4S2 |
|---|---|
| Molecular Weight | 240.05 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 85.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 240.049 |
| Heavy Atoms | 14 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 1113-14-0 |
|---|---|
| SMILES | CCCS(=O)(=O)C=CS(=O)(=O)CCC |
| InChIKey | YTPMCWYIRHLEGM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Di(propylsulfonyl)ethene (CAS 1113-14-0), with molecular formula C8H16O4S2 and molecular weight 240.05 g/mol. IUPAC: 1-(2-propylsulfonylethenylsulfonyl)propane.
Chemical Property Profile of Di(propylsulfonyl)ethene
Property Insights of Di(propylsulfonyl)ethene
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Di(propylsulfonyl)ethene. The TPSA of 85.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Di(propylsulfonyl)ethene. Following Lipinski's Rule of Five, Di(propylsulfonyl)ethene 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
Frequently Asked Questions
What is the CAS number of Di(propylsulfonyl)ethene?
The CAS number of Di(propylsulfonyl)ethene is 1113-14-0.
What is the molecular formula of Di(propylsulfonyl)ethene?
The molecular formula of Di(propylsulfonyl)ethene is C8H16O4S2.
What is the molecular weight of Di(propylsulfonyl)ethene?
The molecular weight of Di(propylsulfonyl)ethene is 240.05 g/mol.
Where can I buy Di(propylsulfonyl)ethene?
You can request a quote for Di(propylsulfonyl)ethene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di(propylsulfonyl)ethene?
Yes, KEHONG BIO provides custom synthesis services for Di(propylsulfonyl)ethene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.