2,5-Dihydroxy-4-octadecylbenzenesulphonic acid
TL;DR: 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid (CAS 6596-77-6) is a chemical compound with molecular formula C24H42O5S and molecular weight 442.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dihydroxy-4-octadecylbenzenesulfonic acid
Also Known As: 2-Octadecyl-5-sulfo-hydrochinon, 2,5-dihydroxy-4-octadecylbenzenesulfonic acid, 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid, 2,5-dihydroxy-4-octadecylbenzenesulphonicacid, 2,5-dihydroxy-4-octadecylbenzene-1-sulfonic acid
| Molecular Formula | C24H42O5S |
|---|---|
| Molecular Weight | 442.28 g/mol |
| LogP | 10.0 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 18 |
| Exact Mass | 442.2753 |
| Heavy Atoms | 30 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 6596-77-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCC1=CC(=C(C=C1O)S(=O)(=O)O)O |
| InChIKey | GMEWXTUITOHSIL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Dihydroxy-4-octadecylbenzenesulphonic acid (CAS 6596-77-6), with molecular formula C24H42O5S and molecular weight 442.28 g/mol. IUPAC: 2,5-dihydroxy-4-octadecylbenzenesulfonic acid.
Chemical Property Profile of 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid
Property Insights of 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid
The XLogP value of 10.0 indicates that 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid. Following Lipinski's Rule of Five, 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid?
The CAS number of 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid is 6596-77-6.
What is the molecular formula of 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid?
The molecular formula of 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid is C24H42O5S.
What is the molecular weight of 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid?
The molecular weight of 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid is 442.28 g/mol.
Where can I buy 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid?
You can request a quote for 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dihydroxy-4-octadecylbenzenesulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.