2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate
TL;DR: 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate (CAS 356569-75-0) is a chemical compound with molecular formula C16H31F3O5S2 and molecular weight 424.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoroethyl 2-dodecylsulfonylethanesulfonate
Also Known As: 2,2,2-trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate, 2,2,2-trifluoroethyl 2-dodecylsulfonylethanesulfonate, F0745-1125, 2,2,2-trifluoroethyl 2-(dodecane-1-sulfonyl)ethane-1-sulfonate, 1-[2-(2,2,2-trifluoroethoxysulfonyl)ethylsulfonyl]dodecane
| Molecular Formula | C16H31F3O5S2 |
|---|---|
| Molecular Weight | 424.16 g/mol |
| LogP | 4.2308 |
| Topological Polar Surface Area | 77.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 16 |
| Exact Mass | 424.1565 |
| Heavy Atoms | 26 |
| Complexity | 556.9245 |
Chemical Identifiers
| CAS Number | 356569-75-0 |
|---|---|
| SMILES | CCCCCCCCCCCCS(=O)(=O)CCS(=O)(=O)OCC(F)(F)F |
Product Overview
2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate (CAS 356569-75-0), with molecular formula C16H31F3O5S2 and molecular weight 424.16 g/mol. IUPAC: 2,2,2-trifluoroethyl 2-dodecylsulfonylethanesulfonate.
Chemical Property Profile of 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate
Property Insights of 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate
The XLogP value of 4.2308 indicates that 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate. Following Lipinski's Rule of Five, 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate has 0 hydrogen bond donor(s) and 5 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 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate?
The CAS number of 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate is 356569-75-0.
What is the molecular formula of 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate?
The molecular formula of 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate is C16H31F3O5S2.
What is the molecular weight of 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate?
The molecular weight of 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate is 424.16 g/mol.
Where can I buy 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate?
You can request a quote for 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-Trifluoroethyl 2-(dodecylsulfonyl)ethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.