3,6'-Methylenebisnaphthalene-2-sulfonic acid
TL;DR: 3,6'-Methylenebisnaphthalene-2-sulfonic acid (CAS 68959-09-1) is a chemical compound with molecular formula C21H16O6S2 and molecular weight 428.03882 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(6-sulfonaphthalen-2-yl)methyl]naphthalene-2-sulfonic acid
Also Known As: 3,6'-Methylenebisnaphthalene-2-sulphonic acid, 3,6'-Methanebis(2-naphthalenesulfonic acid), 2-Naphthalenesulfonic acid, 3-((6-sulfo-2-naphthalenyl)methyl)-, 3,6'-METHYLENEBISNAPHTHALENE-2-SULFONIC ACID, 2-Naphthalenesulfonic acid, 3-[(6-sulfo-2-naphthalenyl)methyl]-
Technical Specifications
| Molecular Formula | C21H16O6S2 |
| Molecular Weight | 428.03882 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 126.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.03882 Da |
| Heavy Atoms | 29 |
| Complexity | 781.0 |
| SMILES | C1=CC=C2C=C(C(=CC2=C1)CC3=CC4=C(C=C3)C=C(C=C4)S(=O)(=O)O)S(=O)(=O)O |
| InChIKey | DPUKNSROARQMKW-UHFFFAOYSA-N |
Chemical Property Profile of 3,6'-Methylenebisnaphthalene-2-sulfonic acid
Property Insights of 3,6'-Methylenebisnaphthalene-2-sulfonic acid
The XLogP value of 3.8 indicates that 3,6'-Methylenebisnaphthalene-2-sulfonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6'-Methylenebisnaphthalene-2-sulfonic acid. Following Lipinski's Rule of Five, 3,6'-Methylenebisnaphthalene-2-sulfonic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,6'-Methylenebisnaphthalene-2-sulfonic acid?
The CAS number of 3,6'-Methylenebisnaphthalene-2-sulfonic acid is 68959-09-1.
What is the molecular formula of 3,6'-Methylenebisnaphthalene-2-sulfonic acid?
The molecular formula of 3,6'-Methylenebisnaphthalene-2-sulfonic acid is C21H16O6S2.
What is the molecular weight of 3,6'-Methylenebisnaphthalene-2-sulfonic acid?
The molecular weight of 3,6'-Methylenebisnaphthalene-2-sulfonic acid is 428.03882 g/mol.
Where can I buy 3,6'-Methylenebisnaphthalene-2-sulfonic acid?
You can request a quote for 3,6'-Methylenebisnaphthalene-2-sulfonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,6'-Methylenebisnaphthalene-2-sulfonic acid?
Yes, CoreyChem provides custom synthesis services for 3,6'-Methylenebisnaphthalene-2-sulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.