Octadecanoic acid, 2-sulfo-, sodium salt (1:2)
TL;DR: Octadecanoic acid, 2-sulfo-, sodium salt (1:2) (CAS 5802-91-5) is a chemical compound with molecular formula C18H34Na2O5S and molecular weight 408.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;2-sulfonatooctadecanoate
Also Known As: Disodium 2-sulphonatooctadecanoate, disodium 2-sulfonatooctadecanoate, sodium,tridecane-1-sulfonate, Octadecanoic acid, 2-sulfo-, disodium salt, Octadecanoic acid, 2-sulfo-, sodium salt
| Molecular Formula | C18H34Na2O5S |
|---|---|
| Molecular Weight | 408.19 g/mol |
| LogP | -2.47 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 408.19223 |
| Heavy Atoms | 26 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 5802-91-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | DBKJZAWCDAODRC-UHFFFAOYSA-L |
Product Overview
Octadecanoic acid, 2-sulfo-, sodium salt (1:2) (CAS 5802-91-5), with molecular formula C18H34Na2O5S and molecular weight 408.19 g/mol. IUPAC: disodium;2-sulfonatooctadecanoate.
Chemical Property Profile of Octadecanoic acid, 2-sulfo-, sodium salt (1:2)
Property Insights of Octadecanoic acid, 2-sulfo-, sodium salt (1:2)
The XLogP value of -2.47 indicates that Octadecanoic acid, 2-sulfo-, sodium salt (1:2) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Octadecanoic acid, 2-sulfo-, sodium salt (1:2). Following Lipinski's Rule of Five, Octadecanoic acid, 2-sulfo-, sodium salt (1:2) has 0 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 Octadecanoic acid, 2-sulfo-, sodium salt (1:2)?
The CAS number of Octadecanoic acid, 2-sulfo-, sodium salt (1:2) is 5802-91-5.
What is the molecular formula of Octadecanoic acid, 2-sulfo-, sodium salt (1:2)?
The molecular formula of Octadecanoic acid, 2-sulfo-, sodium salt (1:2) is C18H34Na2O5S.
What is the molecular weight of Octadecanoic acid, 2-sulfo-, sodium salt (1:2)?
The molecular weight of Octadecanoic acid, 2-sulfo-, sodium salt (1:2) is 408.19 g/mol.
Where can I buy Octadecanoic acid, 2-sulfo-, sodium salt (1:2)?
You can request a quote for Octadecanoic acid, 2-sulfo-, sodium salt (1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadecanoic acid, 2-sulfo-, sodium salt (1:2)?
Yes, KEHONG BIO provides custom synthesis services for Octadecanoic acid, 2-sulfo-, sodium salt (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.