Octadecylbenzenesulphonic acid
TL;DR: Octadecylbenzenesulphonic acid (CAS 79840-55-4) is a chemical compound with molecular formula C24H42O3S and molecular weight 410.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-octadecylbenzenesulfonic acid
Also Known As: Octadecylbenzenesulphonic acid, 2-octadecylbenzenesulfonic acid, EINECS 249-268-2, EINECS 298-607-0, 2-octadecylbenzene-1-sulfonic acid
| Molecular Formula | C24H42O3S |
|---|---|
| Molecular Weight | 410.29 g/mol |
| LogP | 7.7373 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Exact Mass | 410.28546 |
| Heavy Atoms | 28 |
| Complexity | 595.62274 |
Chemical Identifiers
| CAS Number | 79840-55-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O |
Product Overview
Octadecylbenzenesulphonic acid (CAS 79840-55-4), with molecular formula C24H42O3S and molecular weight 410.29 g/mol. IUPAC: 2-octadecylbenzenesulfonic acid.
Chemical Property Profile of Octadecylbenzenesulphonic acid
Property Insights of Octadecylbenzenesulphonic acid
The XLogP value of 7.7373 indicates that Octadecylbenzenesulphonic 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, Octadecylbenzenesulphonic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octadecylbenzenesulphonic 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 Octadecylbenzenesulphonic acid?
The CAS number of Octadecylbenzenesulphonic acid is 79840-55-4.
What is the molecular formula of Octadecylbenzenesulphonic acid?
The molecular formula of Octadecylbenzenesulphonic acid is C24H42O3S.
What is the molecular weight of Octadecylbenzenesulphonic acid?
The molecular weight of Octadecylbenzenesulphonic acid is 410.29 g/mol.
Where can I buy Octadecylbenzenesulphonic acid?
You can request a quote for Octadecylbenzenesulphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadecylbenzenesulphonic acid?
Yes, KEHONG BIO provides custom synthesis services for Octadecylbenzenesulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.