8-aminopyrene-1,3,6-trisulfonic Acid
TL;DR: 8-aminopyrene-1,3,6-trisulfonic Acid (CAS 196504-57-1) is a chemical compound with molecular formula C16H11NO9S3 and molecular weight 456.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-aminopyrene-1,3,6-trisulfonic acid
Also Known As: 8-aminopyrene-1,3,6-trisulfonic Acid, 8-aminopyrene-1,3,6-trisulfonate, 1,3,6-Pyrenetrisulfonic acid,8-amino, 1-aminopyrene-3,6,8-trisulfonic acid, 8-amino-1,3,6-pyrenetrisulfonic acid
| Molecular Formula | C16H11NO9S3 |
|---|---|
| Molecular Weight | 456.96 g/mol |
| LogP | 1.9063 |
| Topological Polar Surface Area | 189.13 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 456.9596 |
| Heavy Atoms | 29 |
| Complexity | 1620.4385 |
Chemical Identifiers
| CAS Number | 196504-57-1 |
|---|---|
| SMILES | C1=CC2=C3C(=C(C=C2S(=O)(=O)O)S(=O)(=O)O)C=CC4=C(C=C(C1=C43)N)S(=O)(=O)O |
Product Overview
8-aminopyrene-1,3,6-trisulfonic Acid (CAS 196504-57-1), with molecular formula C16H11NO9S3 and molecular weight 456.96 g/mol. IUPAC: 8-aminopyrene-1,3,6-trisulfonic acid.
Chemical Property Profile of 8-aminopyrene-1,3,6-trisulfonic Acid
Property Insights of 8-aminopyrene-1,3,6-trisulfonic Acid
The XLogP value of 1.9063 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-aminopyrene-1,3,6-trisulfonic Acid. The TPSA of 189.13 Ų indicates high polarity, suggesting 8-aminopyrene-1,3,6-trisulfonic Acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 8-aminopyrene-1,3,6-trisulfonic Acid has 4 hydrogen bond donor(s) and 7 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 8-aminopyrene-1,3,6-trisulfonic Acid?
The CAS number of 8-aminopyrene-1,3,6-trisulfonic Acid is 196504-57-1.
What is the molecular formula of 8-aminopyrene-1,3,6-trisulfonic Acid?
The molecular formula of 8-aminopyrene-1,3,6-trisulfonic Acid is C16H11NO9S3.
What is the molecular weight of 8-aminopyrene-1,3,6-trisulfonic Acid?
The molecular weight of 8-aminopyrene-1,3,6-trisulfonic Acid is 456.96 g/mol.
Where can I buy 8-aminopyrene-1,3,6-trisulfonic Acid?
You can request a quote for 8-aminopyrene-1,3,6-trisulfonic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-aminopyrene-1,3,6-trisulfonic Acid?
Yes, KEHONG BIO provides custom synthesis services for 8-aminopyrene-1,3,6-trisulfonic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.