Caprylic acid, barium salt
TL;DR: Caprylic acid, barium salt (CAS 4696-54-2) is a chemical compound with molecular formula C16H30BaO4 and molecular weight 424.11966 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
barium(2+);bis(octanoate)
Also Known As: Barium octanoate, Barium octoate, Barium caprylate, Nikkaocthix Barium, Barium dioctanoate
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H30BaO4 |
| Molecular Weight | 424.11966 g/mol |
| XLogP | 1.81 |
| Topological Polar Surface Area (TPSA) | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 424.11966 Da |
| Heavy Atoms | 21 |
| Complexity | 83.0 |
| SMILES | CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Ba+2] |
| InChIKey | PJUKKJYOSBWEQO-UHFFFAOYSA-L |
Product Description
Applications: Caprylic acid, barium salt is used in polymer chemistry and functional materials synthesis, as well as polymer additives and plastics compounding. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A polymer intermediate supplied by CoreyChem, Caprylic acid, barium salt (CAS 4696-54-2) has the molecular formula C16H30BaO4 and a molecular weight of 424.12 g/mol. Synonyms include Barium octanoate and Barium octoate.
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 Caprylic acid, barium salt
Property Insights of Caprylic acid, barium salt
The XLogP value of 1.81 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Caprylic acid, barium salt. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Caprylic acid, barium salt. Following Lipinski's Rule of Five, Caprylic acid, barium salt has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Caprylic acid, barium salt?
The CAS number of Caprylic acid, barium salt is 4696-54-2.
What is the molecular formula of Caprylic acid, barium salt?
The molecular formula of Caprylic acid, barium salt is C16H30BaO4.
What is the molecular weight of Caprylic acid, barium salt?
The molecular weight of Caprylic acid, barium salt is 424.11966 g/mol.
What are the applications of Caprylic acid, barium salt?
Caprylic acid, barium salt is used in polymer chemistry and functional materials synthesis, as well as polymer additives and plastics compounding. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project...
Where can I buy Caprylic acid, barium salt?
You can request a quote for Caprylic acid, barium salt directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Caprylic acid, barium salt?
Yes, CoreyChem provides custom synthesis services for Caprylic acid, barium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.