Calcium nonanoate
TL;DR: Calcium nonanoate (CAS 29813-38-5) is a chemical compound with molecular formula C18H34CaO4 and molecular weight 354.2083 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
calcium bis(nonanoate)
Also Known As: Calcium nonanoate, Calcium pelargonate, Calcium nonan-1-oate, Calcium dinonanoate, Calcium isononanoate
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H34CaO4 |
| Molecular Weight | 354.2083 g/mol |
| XLogP | 2.59 |
| Topological Polar Surface Area (TPSA) | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 354.2083 Da |
| Heavy Atoms | 23 |
| Complexity | 94.0 |
| SMILES | CCCCCCCCC(=O)[O-].CCCCCCCCC(=O)[O-].[Ca+2] |
| InChIKey | QSSGIYRIEKPVTG-UHFFFAOYSA-L |
Chemical Property Profile of Calcium nonanoate
Property Insights of Calcium nonanoate
The XLogP value of 2.59 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Calcium nonanoate. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Calcium nonanoate. Following Lipinski's Rule of Five, Calcium nonanoate 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 Calcium nonanoate?
The CAS number of Calcium nonanoate is 29813-38-5.
What is the molecular formula of Calcium nonanoate?
The molecular formula of Calcium nonanoate is C18H34CaO4.
What is the molecular weight of Calcium nonanoate?
The molecular weight of Calcium nonanoate is 354.2083 g/mol.
Where can I buy Calcium nonanoate?
You can request a quote for Calcium nonanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Calcium nonanoate?
Yes, CoreyChem provides custom synthesis services for Calcium nonanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.