Tridecyl Isononanoate
TL;DR: Tridecyl Isononanoate (CAS 125804-18-4) is a chemical compound with molecular formula C22H44O2 and molecular weight 340.33414 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tridecyl 7-methyloctanoate
Also Known As: Tridecyl isononanoate, Tridecyl 7-methyloctanoate, Isononanoic acid, tridecyl ester, tridecyl7-methyloctanoate, Isononanoic acid,tridecyl ester
Technical Specifications
| Molecular Formula | C22H44O2 |
| Molecular Weight | 340.33414 g/mol |
| XLogP | 9.5 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 19 |
| Exact Mass | 340.33414 Da |
| Heavy Atoms | 24 |
| Complexity | 261.0 |
| SMILES | CCCCCCCCCCCCCOC(=O)CCCCCC(C)C |
| InChIKey | NRLLZRJXDKUVHM-UHFFFAOYSA-N |
Chemical Property Profile of Tridecyl Isononanoate
Property Insights of Tridecyl Isononanoate
The XLogP value of 9.5 indicates that Tridecyl Isononanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Tridecyl Isononanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tridecyl Isononanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Tridecyl Isononanoate?
The CAS number of Tridecyl Isononanoate is 125804-18-4.
What is the molecular formula of Tridecyl Isononanoate?
The molecular formula of Tridecyl Isononanoate is C22H44O2.
What is the molecular weight of Tridecyl Isononanoate?
The molecular weight of Tridecyl Isononanoate is 340.33414 g/mol.
Where can I buy Tridecyl Isononanoate?
You can request a quote for Tridecyl Isononanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tridecyl Isononanoate?
Yes, CoreyChem provides custom synthesis services for Tridecyl Isononanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.