5-Hexyl-2,4-dihydroxybenzenesulfonic acid
TL;DR: 5-Hexyl-2,4-dihydroxybenzenesulfonic acid (CAS 6623-92-3) is a chemical compound with molecular formula C12H18O5S and molecular weight 274.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hexyl-2,4-dihydroxybenzenesulfonic acid
Also Known As: 5-Hexyl-2,4-dihydroxybenzenesulfonic acid, NCIOpen2_002176, 5-hexyl-2,4-dihydroxy-benzenesulfonic acid, 5-Hexyl-2,4-dihydroxybenzene-1-sulfonic acid
| Molecular Formula | C12H18O5S |
|---|---|
| Molecular Weight | 274.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 274.0875 |
| Heavy Atoms | 18 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 6623-92-3 |
|---|---|
| SMILES | CCCCCCC1=CC(=C(C=C1O)O)S(=O)(=O)O |
| InChIKey | YVERZAZYTFUQAG-UHFFFAOYSA-N |
Product Overview
5-Hexyl-2,4-dihydroxybenzenesulfonic acid (CAS 6623-92-3), with molecular formula C12H18O5S and molecular weight 274.09 g/mol. IUPAC: 5-hexyl-2,4-dihydroxybenzenesulfonic acid.
Chemical Property Profile of 5-Hexyl-2,4-dihydroxybenzenesulfonic acid
Property Insights of 5-Hexyl-2,4-dihydroxybenzenesulfonic acid
The XLogP value of 3.5 indicates that 5-Hexyl-2,4-dihydroxybenzenesulfonic 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 5-Hexyl-2,4-dihydroxybenzenesulfonic acid. Following Lipinski's Rule of Five, 5-Hexyl-2,4-dihydroxybenzenesulfonic acid has 3 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 5-Hexyl-2,4-dihydroxybenzenesulfonic acid?
The CAS number of 5-Hexyl-2,4-dihydroxybenzenesulfonic acid is 6623-92-3.
What is the molecular formula of 5-Hexyl-2,4-dihydroxybenzenesulfonic acid?
The molecular formula of 5-Hexyl-2,4-dihydroxybenzenesulfonic acid is C12H18O5S.
What is the molecular weight of 5-Hexyl-2,4-dihydroxybenzenesulfonic acid?
The molecular weight of 5-Hexyl-2,4-dihydroxybenzenesulfonic acid is 274.09 g/mol.
Where can I buy 5-Hexyl-2,4-dihydroxybenzenesulfonic acid?
You can request a quote for 5-Hexyl-2,4-dihydroxybenzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hexyl-2,4-dihydroxybenzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Hexyl-2,4-dihydroxybenzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.