1,6-Cleve's acid
TL;DR: 1,6-Cleve's acid (CAS 119-79-9) is a chemical compound with molecular formula C10H9NO3S and molecular weight 223.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-aminonaphthalene-2-sulfonic acid
Also Known As: 5-Amino-2-naphthalenesulfonic acid, 1,6-Cleve's acid, 5-aminonaphthalene-2-sulfonic acid, Kyselina cleve, Cleve's beta-acid
| Molecular Formula | C10H9NO3S |
|---|---|
| Molecular Weight | 223.03 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 88.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.03032 |
| Heavy Atoms | 15 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 119-79-9 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=C2)S(=O)(=O)O)C(=C1)N |
| InChIKey | UWPJYQYRSWYIGZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,6-Cleve's acid (CAS 119-79-9), with molecular formula C10H9NO3S and molecular weight 223.03 g/mol. IUPAC: 5-aminonaphthalene-2-sulfonic acid.
Chemical Property Profile of 1,6-Cleve's acid
Property Insights of 1,6-Cleve's acid
The XLogP value of -0.1 indicates that 1,6-Cleve's acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,6-Cleve's acid. Following Lipinski's Rule of Five, 1,6-Cleve's acid has 2 hydrogen bond donor(s) and 4 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 1,6-Cleve's acid?
The CAS number of 1,6-Cleve's acid is 119-79-9.
What is the molecular formula of 1,6-Cleve's acid?
The molecular formula of 1,6-Cleve's acid is C10H9NO3S.
What is the molecular weight of 1,6-Cleve's acid?
The molecular weight of 1,6-Cleve's acid is 223.03 g/mol.
Where can I buy 1,6-Cleve's acid?
You can request a quote for 1,6-Cleve's acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-Cleve's acid?
Yes, KEHONG BIO provides custom synthesis services for 1,6-Cleve's acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.