Tridecyl Isononanoate
TL;DR: Tridecyl Isononanoate (CAS 125804-18-4) is a chemical compound with molecular formula C22H44O2 and molecular weight 340.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tridecyl 7-methyloctanoate
Also Known As: Tridecyl isononanoate, Tridecyl 7-methyloctanoate, Isononanoic acid, tridecyl ester, tridecyl7-methyloctanoate, Isononanoic acid,tridecyl ester
| Molecular Formula | C22H44O2 |
|---|---|
| Molecular Weight | 340.33 g/mol |
| LogP | 7.4471 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Exact Mass | 340.33414 |
| Heavy Atoms | 24 |
| Complexity | 260.69553 |
Chemical Identifiers
| CAS Number | 125804-18-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCOC(=O)CCCCCC(C)C |
Product Overview
Tridecyl Isononanoate (CAS 125804-18-4), with molecular formula C22H44O2 and molecular weight 340.33 g/mol. IUPAC: tridecyl 7-methyloctanoate.
Chemical Property Profile of Tridecyl Isononanoate
Property Insights of Tridecyl Isononanoate
The XLogP value of 7.4471 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
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 340.33 g/mol.
Where can I buy Tridecyl Isononanoate?
You can request a quote for Tridecyl Isononanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tridecyl Isononanoate?
Yes, KEHONG BIO provides custom synthesis services for Tridecyl Isononanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.