4-Decylbenzenesulfonic acid
TL;DR: 4-Decylbenzenesulfonic acid (CAS 140-60-3) is a chemical compound with molecular formula C16H26O3S and molecular weight 298.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-decylbenzenesulfonic acid
Also Known As: p-Decylbenzenesulfonic acid, 4-DECYLBENZENESULFONIC ACID, p-N-Decylbenzenesulfonate, p-Decylbenzenesulphonic acid, Benzenesulfonic acid, 4-decyl-
| Molecular Formula | C16H26O3S |
|---|---|
| Molecular Weight | 298.16 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 298.16028 |
| Heavy Atoms | 20 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 140-60-3 |
|---|---|
| SMILES | CCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O |
| InChIKey | UASQKKHYUPBQJR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Decylbenzenesulfonic acid (CAS 140-60-3), with molecular formula C16H26O3S and molecular weight 298.16 g/mol. IUPAC: 4-decylbenzenesulfonic acid.
Chemical Property Profile of 4-Decylbenzenesulfonic acid
Property Insights of 4-Decylbenzenesulfonic acid
The XLogP value of 5.9 indicates that 4-Decylbenzenesulfonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Decylbenzenesulfonic acid. Following Lipinski's Rule of Five, 4-Decylbenzenesulfonic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Decylbenzenesulfonic acid?
The CAS number of 4-Decylbenzenesulfonic acid is 140-60-3.
What is the molecular formula of 4-Decylbenzenesulfonic acid?
The molecular formula of 4-Decylbenzenesulfonic acid is C16H26O3S.
What is the molecular weight of 4-Decylbenzenesulfonic acid?
The molecular weight of 4-Decylbenzenesulfonic acid is 298.16 g/mol.
Where can I buy 4-Decylbenzenesulfonic acid?
You can request a quote for 4-Decylbenzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Decylbenzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Decylbenzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.