Barium anilinobenzenesulphonate
TL;DR: Barium anilinobenzenesulphonate (CAS 6322-81-2) is a chemical compound with molecular formula C24H20BaN2O6S2 and molecular weight 633.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-anilinobenzenesulfonate);barium(2+)
Also Known As: Barium anilinobenzenesulphonate, Barium diphenylaminesulfonate, 2-anilinobenzenesulfonate;barium(2+), Diphenylamine-4-sulfonic acid barium salt, barium bis(2-anilinobenzenesulfonate)
| Molecular Formula | C24H20BaN2O6S2 |
|---|---|
| Molecular Weight | 633.98 g/mol |
| LogP | 4.2878 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 633.9815 |
| Heavy Atoms | 35 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 6322-81-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=CC=CC=C2S(=O)(=O)[O-].C1=CC=C(C=C1)NC2=CC=CC=C2S(=O)(=O)[O-].[Ba+2] |
| InChIKey | JWTHKGUPPCYKNI-UHFFFAOYSA-L |
Product Overview
Barium anilinobenzenesulphonate (CAS 6322-81-2), with molecular formula C24H20BaN2O6S2 and molecular weight 633.98 g/mol. IUPAC: bis(2-anilinobenzenesulfonate);barium(2+).
Chemical Property Profile of Barium anilinobenzenesulphonate
Property Insights of Barium anilinobenzenesulphonate
The XLogP value of 4.2878 indicates that Barium anilinobenzenesulphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 155.0 Ų indicates high polarity, suggesting Barium anilinobenzenesulphonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Barium anilinobenzenesulphonate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Barium anilinobenzenesulphonate?
The CAS number of Barium anilinobenzenesulphonate is 6322-81-2.
What is the molecular formula of Barium anilinobenzenesulphonate?
The molecular formula of Barium anilinobenzenesulphonate is C24H20BaN2O6S2.
What is the molecular weight of Barium anilinobenzenesulphonate?
The molecular weight of Barium anilinobenzenesulphonate is 633.98 g/mol.
Where can I buy Barium anilinobenzenesulphonate?
You can request a quote for Barium anilinobenzenesulphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Barium anilinobenzenesulphonate?
Yes, KEHONG BIO provides custom synthesis services for Barium anilinobenzenesulphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.