Ethyl 2-pentylnonanoate
TL;DR: Ethyl 2-pentylnonanoate (CAS 102433-42-1) is a chemical compound with molecular formula C16H32O2 and molecular weight 256.24023 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-pentylnonanoate
Also Known As: ethyl 2-pentylnonanoate
Technical Specifications
| Molecular Formula | C16H32O2 |
| Molecular Weight | 256.24023 g/mol |
| XLogP | 6.6 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 256.24023 Da |
| Heavy Atoms | 18 |
| Complexity | 190.0 |
| SMILES | CCCCCCCC(CCCCC)C(=O)OCC |
| InChIKey | QPMKKOWLFUFCBR-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-pentylnonanoate
Property Insights of Ethyl 2-pentylnonanoate
The XLogP value of 6.6 indicates that Ethyl 2-pentylnonanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl 2-pentylnonanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-pentylnonanoate 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 Ethyl 2-pentylnonanoate?
The CAS number of Ethyl 2-pentylnonanoate is 102433-42-1.
What is the molecular formula of Ethyl 2-pentylnonanoate?
The molecular formula of Ethyl 2-pentylnonanoate is C16H32O2.
What is the molecular weight of Ethyl 2-pentylnonanoate?
The molecular weight of Ethyl 2-pentylnonanoate is 256.24023 g/mol.
Where can I buy Ethyl 2-pentylnonanoate?
You can request a quote for Ethyl 2-pentylnonanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-pentylnonanoate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-pentylnonanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.