Barium bis(4-nitrophenolate)
TL;DR: Barium bis(4-nitrophenolate) (CAS 34005-61-3) is a chemical compound with molecular formula C12H8BaN2O6 and molecular weight 413.94348 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
barium(2+);bis(4-nitrophenolate)
Also Known As: p-Nitrophenol barium salt, barium bis(4-nitrophenolate), Phenol, p-nitro-, barium salt, barium(2+);4-nitrophenolate, barium(2+); 4-nitrophenolate
Technical Specifications
| Molecular Formula | C12H8BaN2O6 |
| Molecular Weight | 413.94348 g/mol |
| XLogP | 0.96 |
| Topological Polar Surface Area (TPSA) | 138.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 413.94348 Da |
| Heavy Atoms | 21 |
| Complexity | 123.0 |
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])[O-].C1=CC(=CC=C1[N+](=O)[O-])[O-].[Ba+2] |
| InChIKey | KWULIWZLWRYXRG-UHFFFAOYSA-L |
Product Description
Applications: Barium bis(4-nitrophenolate) is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Barium bis(4-nitrophenolate) (CAS 34005-61-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A fine chemical supplied by CoreyChem, Barium bis(4-nitrophenolate) (CAS 34005-61-3) has the molecular formula C12H8BaN2O6 and a molecular weight of 413.94 g/mol. It is also known as p-Nitrophenol barium salt and barium bis(4-nitrophenolate).
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Barium bis(4-nitrophenolate)
Property Insights of Barium bis(4-nitrophenolate)
The XLogP value of 0.96 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barium bis(4-nitrophenolate). The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Barium bis(4-nitrophenolate). Following Lipinski's Rule of Five, Barium bis(4-nitrophenolate) has 0 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 Barium bis(4-nitrophenolate)?
The CAS number of Barium bis(4-nitrophenolate) is 34005-61-3.
What is the molecular formula of Barium bis(4-nitrophenolate)?
The molecular formula of Barium bis(4-nitrophenolate) is C12H8BaN2O6.
What is the molecular weight of Barium bis(4-nitrophenolate)?
The molecular weight of Barium bis(4-nitrophenolate) is 413.94348 g/mol.
What are the applications of Barium bis(4-nitrophenolate)?
Barium bis(4-nitrophenolate) is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Barium bis(4-nitrophenolate) (CAS 34005-61-3) with custom synthesis available from milligram to multi-kilogram scale,...
Where can I buy Barium bis(4-nitrophenolate)?
You can request a quote for Barium bis(4-nitrophenolate) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Barium bis(4-nitrophenolate)?
Yes, CoreyChem provides custom synthesis services for Barium bis(4-nitrophenolate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.