Acetic acid, sulfo-, 1-dodecyl ester
TL;DR: Acetic acid, sulfo-, 1-dodecyl ester (CAS 142-52-9) is a chemical compound with molecular formula C14H28O5S and molecular weight 308.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-dodecoxy-2-oxoethanesulfonic acid
Also Known As: lauryl sulfoacetate, Sodium lauryl sulfoacetate, Acetic acid, sulfo-, 1-dodecyl ester, 2-dodecoxy-2-oxoethanesulfonic acid, Dodecoxycarbonylmethanesulfonic Acid
| Molecular Formula | C14H28O5S |
|---|---|
| Molecular Weight | 308.17 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 89.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 14 |
| Exact Mass | 308.16574 |
| Heavy Atoms | 20 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 142-52-9 |
|---|---|
| SMILES | CCCCCCCCCCCCOC(=O)CS(=O)(=O)O |
| InChIKey | LBIZZGIYNNLXQN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetic acid, sulfo-, 1-dodecyl ester (CAS 142-52-9), with molecular formula C14H28O5S and molecular weight 308.17 g/mol. IUPAC: 2-dodecoxy-2-oxoethanesulfonic acid.
Chemical Property Profile of Acetic acid, sulfo-, 1-dodecyl ester
Property Insights of Acetic acid, sulfo-, 1-dodecyl ester
The XLogP value of 4.6 indicates that Acetic acid, sulfo-, 1-dodecyl ester 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 Acetic acid, sulfo-, 1-dodecyl ester. Following Lipinski's Rule of Five, Acetic acid, sulfo-, 1-dodecyl ester 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 Acetic acid, sulfo-, 1-dodecyl ester?
The CAS number of Acetic acid, sulfo-, 1-dodecyl ester is 142-52-9.
What is the molecular formula of Acetic acid, sulfo-, 1-dodecyl ester?
The molecular formula of Acetic acid, sulfo-, 1-dodecyl ester is C14H28O5S.
What is the molecular weight of Acetic acid, sulfo-, 1-dodecyl ester?
The molecular weight of Acetic acid, sulfo-, 1-dodecyl ester is 308.17 g/mol.
Where can I buy Acetic acid, sulfo-, 1-dodecyl ester?
You can request a quote for Acetic acid, sulfo-, 1-dodecyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, sulfo-, 1-dodecyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, sulfo-, 1-dodecyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.