![3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid structure](/static/products/1663/166301-18-4.webp)
3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid
TL;DR: 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid (CAS 166301-18-4) is a chemical compound with molecular formula C26H20N2O6S2 and molecular weight 520.0763 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2,9-dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid
Also Known As: bathocuproine-3,4'-disulfonic acid, J1.542.738H, 3-[2,9-dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic Acid, 3,4 -(2,9-Dimethyl-1,10-phenanthroline-4,7-diyl)bis(benzenesulfonic acid), 4-[2,9-dimethyl-7-(3-sulfophenyl)-1,10-phenanthrolin-4-yl]benzene-1-sulfonic acid
Technical Specifications
| Molecular Formula | C26H20N2O6S2 |
| Molecular Weight | 520.0763 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 151.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 520.0763 Da |
| Heavy Atoms | 36 |
| Complexity | 985.0 |
| SMILES | CC1=CC(=C2C=CC3=C(C=C(N=C3C2=N1)C)C4=CC(=CC=C4)S(=O)(=O)O)C5=CC=C(C=C5)S(=O)(=O)O |
| InChIKey | BGVNHXITJIMODX-UHFFFAOYSA-N |
Chemical Property Profile of 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid
Property Insights of 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid
The XLogP value of 4.0 indicates that 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.0 Ų indicates high polarity, suggesting 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid?
The CAS number of 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid is 166301-18-4.
What is the molecular formula of 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid?
The molecular formula of 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid is C26H20N2O6S2.
What is the molecular weight of 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid?
The molecular weight of 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid is 520.0763 g/mol.
Where can I buy 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid?
You can request a quote for 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid?
Yes, CoreyChem provides custom synthesis services for 3-[2,9-Dimethyl-7-(4-sulfophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.