Naphthalenesulfonic acid, dinonyl-, barium salt (2:1)
TL;DR: Naphthalenesulfonic acid, dinonyl-, barium salt (2:1) (CAS 90873-38-4) is a chemical compound with molecular formula C56H86BaO6S2 and molecular weight 1056.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
barium(2+);bis(2,3-di(nonyl)naphthalene-1-sulfonate)
Also Known As: Naphthalenesulfonic acid, dinonyl-, barium salt, Barium dinonylnaphthalenesulfonate, Barium bis(dinonylnaphthalenesulphonate), barium dinonylnaphthalene sulfonate, Naphthalenesulfonicacid, dinonyl-, barium salt (2:1)
| Molecular Formula | C56H86BaO6S2 |
|---|---|
| Molecular Weight | 1056.49 g/mol |
| LogP | 16.2794 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 32 |
| Exact Mass | 1056.4918 |
| Heavy Atoms | 65 |
| Complexity | 554.0 |
Chemical Identifiers
| CAS Number | 90873-38-4 |
|---|---|
| SMILES | CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCC)S(=O)(=O)[O-].CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCC)S(=O)(=O)[O-].[Ba+2] |
| InChIKey | YSIQDTZQRDDQNF-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Naphthalenesulfonic acid, dinonyl-, barium salt (2:1) (CAS 90873-38-4), with molecular formula C56H86BaO6S2 and molecular weight 1056.49 g/mol. IUPAC: barium(2+);bis(2,3-di(nonyl)naphthalene-1-sulfonate).
Chemical Property Profile of Naphthalenesulfonic acid, dinonyl-, barium salt (2:1)
Property Insights of Naphthalenesulfonic acid, dinonyl-, barium salt (2:1)
The XLogP value of 16.2794 indicates that Naphthalenesulfonic acid, dinonyl-, barium salt (2:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Naphthalenesulfonic acid, dinonyl-, barium salt (2:1). Following Lipinski's Rule of Five, Naphthalenesulfonic acid, dinonyl-, barium salt (2:1) has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Naphthalenesulfonic acid, dinonyl-, barium salt (2:1)?
The CAS number of Naphthalenesulfonic acid, dinonyl-, barium salt (2:1) is 90873-38-4.
What is the molecular formula of Naphthalenesulfonic acid, dinonyl-, barium salt (2:1)?
The molecular formula of Naphthalenesulfonic acid, dinonyl-, barium salt (2:1) is C56H86BaO6S2.
What is the molecular weight of Naphthalenesulfonic acid, dinonyl-, barium salt (2:1)?
The molecular weight of Naphthalenesulfonic acid, dinonyl-, barium salt (2:1) is 1056.49 g/mol.
Where can I buy Naphthalenesulfonic acid, dinonyl-, barium salt (2:1)?
You can request a quote for Naphthalenesulfonic acid, dinonyl-, barium salt (2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthalenesulfonic acid, dinonyl-, barium salt (2:1)?
Yes, KEHONG BIO provides custom synthesis services for Naphthalenesulfonic acid, dinonyl-, barium salt (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.