(癸磺酰基)乙酸乙酯
TL;DR: (癸磺酰基)乙酸乙酯 (CAS 5825-81-0) is a chemical compound with molecular formula C14H28O4S and molecular weight 292.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(癸磺酰基)乙酸乙酯
ethyl 2-decylsulfonylacetate
Also Known As: ethyl(decylsulfonyl)acetate, ethyl 2-decylsulfonylacetate, Decylsulfonessigsaeure-aethylester, Ethyl (decane-1-sulfonyl)acetate, (DECYLSULFONYL)ACETIC ACID, ETHYL ESTER
| Molecular Formula | C14H28O4S |
|---|---|
| Molecular Weight | 292.17 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 68.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 292.17084 |
| Heavy Atoms | 19 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 5825-81-0 |
|---|---|
| SMILES | CCCCCCCCCCS(=O)(=O)CC(=O)OCC |
| InChIKey | QRCVQALBVAKYGI-UHFFFAOYSA-N |
Product Overview
(癸磺酰基)乙酸乙酯 (CAS 5825-81-0), with molecular formula C14H28O4S and molecular weight 292.17 g/mol. IUPAC: ethyl 2-decylsulfonylacetate.
Chemical Property Profile of (癸磺酰基)乙酸乙酯
Property Insights of (癸磺酰基)乙酸乙酯
The XLogP value of 4.4 indicates that (癸磺酰基)乙酸乙酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (癸磺酰基)乙酸乙酯. Following Lipinski's Rule of Five, (癸磺酰基)乙酸乙酯 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 (癸磺酰基)乙酸乙酯?
The CAS number of (癸磺酰基)乙酸乙酯 is 5825-81-0.
What is the molecular formula of (癸磺酰基)乙酸乙酯?
The molecular formula of (癸磺酰基)乙酸乙酯 is C14H28O4S.
What is the molecular weight of (癸磺酰基)乙酸乙酯?
The molecular weight of (癸磺酰基)乙酸乙酯 is 292.17 g/mol.
Where can I buy (癸磺酰基)乙酸乙酯?
You can request a quote for (癸磺酰基)乙酸乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (癸磺酰基)乙酸乙酯?
Yes, KEHONG BIO provides custom synthesis services for (癸磺酰基)乙酸乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.