Octadecylxylenesulphonic acid
TL;DR: Octadecylxylenesulphonic acid (CAS 55121-81-8) is a chemical compound with molecular formula C26H46O3S and molecular weight 438.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)nonadecane-1-sulfonic acid
Also Known As: Octadecylxylenesulphonic acid, octadecylxylenesulphonicacid, EINECS 259-489-6, OCTADECYLXYLENESULFONIC ACID, Dimethyloctadecylbenzenesulphonic acid
| Molecular Formula | C26H46O3S |
|---|---|
| Molecular Weight | 438.32 g/mol |
| LogP | 8.57552 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 19 |
| Exact Mass | 438.31677 |
| Heavy Atoms | 30 |
| Complexity | 622.1837 |
Chemical Identifiers
| CAS Number | 55121-81-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCC(C1=CC=C(C=C1)C)S(=O)(=O)O |
Product Overview
Octadecylxylenesulphonic acid (CAS 55121-81-8), with molecular formula C26H46O3S and molecular weight 438.32 g/mol. IUPAC: 1-(4-methylphenyl)nonadecane-1-sulfonic acid.
Chemical Property Profile of Octadecylxylenesulphonic acid
Property Insights of Octadecylxylenesulphonic acid
The XLogP value of 8.57552 indicates that Octadecylxylenesulphonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, Octadecylxylenesulphonic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octadecylxylenesulphonic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octadecylxylenesulphonic acid?
The CAS number of Octadecylxylenesulphonic acid is 55121-81-8.
What is the molecular formula of Octadecylxylenesulphonic acid?
The molecular formula of Octadecylxylenesulphonic acid is C26H46O3S.
What is the molecular weight of Octadecylxylenesulphonic acid?
The molecular weight of Octadecylxylenesulphonic acid is 438.32 g/mol.
Where can I buy Octadecylxylenesulphonic acid?
You can request a quote for Octadecylxylenesulphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadecylxylenesulphonic acid?
Yes, KEHONG BIO provides custom synthesis services for Octadecylxylenesulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.