8-Aminonaphthalene-1,3,6-trisulfonic acid
TL;DR: 8-Aminonaphthalene-1,3,6-trisulfonic acid (CAS 117-42-0) is a chemical compound with molecular formula C10H9NO9S3 and molecular weight 382.94394 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-aminonaphthalene-1,3,6-trisulfonic acid
Also Known As: Koch acid, Koch's acid, Amino-H acid, T Acid, Kochacid
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H9NO9S3 |
| Molecular Weight | 382.94394 g/mol |
| XLogP | -1.3 |
| Topological Polar Surface Area (TPSA) | 214.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.94394 Da |
| Heavy Atoms | 23 |
| Complexity | 756.0 |
| SMILES | C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)N)S(=O)(=O)O)S(=O)(=O)O |
| InChIKey | UBDHSURDYAETAL-UHFFFAOYSA-N |
Chemical Property Profile of 8-Aminonaphthalene-1,3,6-trisulfonic acid
Property Insights of 8-Aminonaphthalene-1,3,6-trisulfonic acid
The XLogP value of -1.3 indicates that 8-Aminonaphthalene-1,3,6-trisulfonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 214.0 Ų indicates high polarity, suggesting 8-Aminonaphthalene-1,3,6-trisulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 8-Aminonaphthalene-1,3,6-trisulfonic acid has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 8-Aminonaphthalene-1,3,6-trisulfonic acid?
The CAS number of 8-Aminonaphthalene-1,3,6-trisulfonic acid is 117-42-0.
What is the molecular formula of 8-Aminonaphthalene-1,3,6-trisulfonic acid?
The molecular formula of 8-Aminonaphthalene-1,3,6-trisulfonic acid is C10H9NO9S3.
What is the molecular weight of 8-Aminonaphthalene-1,3,6-trisulfonic acid?
The molecular weight of 8-Aminonaphthalene-1,3,6-trisulfonic acid is 382.94394 g/mol.
Where can I buy 8-Aminonaphthalene-1,3,6-trisulfonic acid?
You can request a quote for 8-Aminonaphthalene-1,3,6-trisulfonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8-Aminonaphthalene-1,3,6-trisulfonic acid?
Yes, CoreyChem provides custom synthesis services for 8-Aminonaphthalene-1,3,6-trisulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.