2-Sulfoethyl oleate
TL;DR: 2-Sulfoethyl oleate (CAS 110-35-0) is a chemical compound with molecular formula C20H38O5S and molecular weight 390.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(Z)-octadec-9-enoyl]oxyethanesulfonic acid
Also Known As: 2-sulfoethyl oleate, Oleoyl Isethionate, Oleyl ester of isethionic acid, OLEOYL ISETHIONIC ACID, 2-[(Z)-octadec-9-enoyl]oxyethanesulfonic Acid
| Molecular Formula | C20H38O5S |
|---|---|
| Molecular Weight | 390.24 g/mol |
| LogP | 5.4549 |
| Topological Polar Surface Area | 80.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 390.244 |
| Heavy Atoms | 26 |
| Complexity | 456.822 |
Chemical Identifiers
| CAS Number | 110-35-0 |
|---|---|
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OCCS(=O)(=O)O |
Product Overview
2-Sulfoethyl oleate (CAS 110-35-0), with molecular formula C20H38O5S and molecular weight 390.24 g/mol. IUPAC: 2-[(Z)-octadec-9-enoyl]oxyethanesulfonic acid.
Chemical Property Profile of 2-Sulfoethyl oleate
Property Insights of 2-Sulfoethyl oleate
The XLogP value of 5.4549 indicates that 2-Sulfoethyl oleate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Sulfoethyl oleate. Following Lipinski's Rule of Five, 2-Sulfoethyl oleate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Sulfoethyl oleate?
The CAS number of 2-Sulfoethyl oleate is 110-35-0.
What is the molecular formula of 2-Sulfoethyl oleate?
The molecular formula of 2-Sulfoethyl oleate is C20H38O5S.
What is the molecular weight of 2-Sulfoethyl oleate?
The molecular weight of 2-Sulfoethyl oleate is 390.24 g/mol.
Where can I buy 2-Sulfoethyl oleate?
You can request a quote for 2-Sulfoethyl oleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Sulfoethyl oleate?
Yes, KEHONG BIO provides custom synthesis services for 2-Sulfoethyl oleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.