Dipotassium 12-(sulfonatooxy)octadec-9-enoate
TL;DR: Dipotassium 12-(sulfonatooxy)octadec-9-enoate (CAS 67785-93-7) is a chemical compound with molecular formula C18H32K2O6S and molecular weight 454.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipotassium;12-sulfonatooxyoctadec-9-enoate
Also Known As: Dipotassium sulforicinoleate, Potassium sulforicinoleate, Dipotassium 12-(sulfonatooxy)octadec-9-enoate, Dipotassium (R)-12-(sulphonatooxy)oleate, dipotassium 12-sulfonatooxyoctadec-9-enoate
| Molecular Formula | C18H32K2O6S |
|---|---|
| Molecular Weight | 454.12 g/mol |
| LogP | -2.76 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 454.1194 |
| Heavy Atoms | 27 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 67785-93-7 |
|---|---|
| SMILES | CCCCCCC(CC=CCCCCCCCC(=O)[O-])OS(=O)(=O)[O-].[K+].[K+] |
| InChIKey | MLXJANQMZFAJBH-UHFFFAOYSA-L |
Product Overview
Dipotassium 12-(sulfonatooxy)octadec-9-enoate (CAS 67785-93-7), with molecular formula C18H32K2O6S and molecular weight 454.12 g/mol. IUPAC: dipotassium;12-sulfonatooxyoctadec-9-enoate.
Chemical Property Profile of Dipotassium 12-(sulfonatooxy)octadec-9-enoate
Property Insights of Dipotassium 12-(sulfonatooxy)octadec-9-enoate
The XLogP value of -2.76 indicates that Dipotassium 12-(sulfonatooxy)octadec-9-enoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dipotassium 12-(sulfonatooxy)octadec-9-enoate. Following Lipinski's Rule of Five, Dipotassium 12-(sulfonatooxy)octadec-9-enoate has 0 hydrogen bond donor(s) and 6 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 Dipotassium 12-(sulfonatooxy)octadec-9-enoate?
The CAS number of Dipotassium 12-(sulfonatooxy)octadec-9-enoate is 67785-93-7.
What is the molecular formula of Dipotassium 12-(sulfonatooxy)octadec-9-enoate?
The molecular formula of Dipotassium 12-(sulfonatooxy)octadec-9-enoate is C18H32K2O6S.
What is the molecular weight of Dipotassium 12-(sulfonatooxy)octadec-9-enoate?
The molecular weight of Dipotassium 12-(sulfonatooxy)octadec-9-enoate is 454.12 g/mol.
Where can I buy Dipotassium 12-(sulfonatooxy)octadec-9-enoate?
You can request a quote for Dipotassium 12-(sulfonatooxy)octadec-9-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dipotassium 12-(sulfonatooxy)octadec-9-enoate?
Yes, KEHONG BIO provides custom synthesis services for Dipotassium 12-(sulfonatooxy)octadec-9-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.