2-磺基癸酸1-甲酯
TL;DR: 2-磺基癸酸1-甲酯 (CAS 64131-26-6) is a chemical compound with molecular formula C11H22O5S and molecular weight 266.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-磺基癸酸1-甲酯
1-methoxy-1-oxodecane-2-sulfonic acid
Also Known As: Methyl 2-sulphodecanoate, 1-Methyl 2-sulfodecanoate, methyl2-sulphodecanoate, Methyl 2-sulfodecanoate, 1-methoxy-1-oxodecane-2-sulfonic acid
| Molecular Formula | C11H22O5S |
|---|---|
| Molecular Weight | 266.12 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 89.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 266.1188 |
| Heavy Atoms | 17 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 64131-26-6 |
|---|---|
| SMILES | CCCCCCCCC(C(=O)OC)S(=O)(=O)O |
| InChIKey | QURGWARQWBLYFU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-磺基癸酸1-甲酯 (CAS 64131-26-6), with molecular formula C11H22O5S and molecular weight 266.12 g/mol. IUPAC: 1-methoxy-1-oxodecane-2-sulfonic acid.
Chemical Property Profile of 2-磺基癸酸1-甲酯
Property Insights of 2-磺基癸酸1-甲酯
The XLogP value of 3.0 indicates that 2-磺基癸酸1-甲酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-磺基癸酸1-甲酯. Following Lipinski's Rule of Five, 2-磺基癸酸1-甲酯 has 1 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-磺基癸酸1-甲酯?
The CAS number of 2-磺基癸酸1-甲酯 is 64131-26-6.
What is the molecular formula of 2-磺基癸酸1-甲酯?
The molecular formula of 2-磺基癸酸1-甲酯 is C11H22O5S.
What is the molecular weight of 2-磺基癸酸1-甲酯?
The molecular weight of 2-磺基癸酸1-甲酯 is 266.12 g/mol.
Where can I buy 2-磺基癸酸1-甲酯?
You can request a quote for 2-磺基癸酸1-甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-磺基癸酸1-甲酯?
Yes, KEHONG BIO provides custom synthesis services for 2-磺基癸酸1-甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.