Ethyl-2-nonynoate
TL;DR: Ethyl-2-nonynoate (CAS 10031-92-2) is a chemical compound with molecular formula C11H18O2 and molecular weight 182.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl non-2-ynoate
Also Known As: Ethyl non-2-ynoate, Ethyl 2-nonynoate, Ethyl-2-nonynoate, Ethyl nonynoate, 2-Nonynoic acid, ethyl ester
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H18O2 |
| Molecular Weight | 182.13068 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 182.13068 Da |
| Heavy Atoms | 13 |
| Complexity | 195.0 |
| Boiling Point | 121.00 to 122.00 °C. @ 13.00 mm Hg |
| Density | 0.901-0.907 |
| Refractive Index | 1.450-1.456 |
| Solubility | Soluble in oils; Insoluble in water |
| SMILES | CCCCCCC#CC(=O)OCC |
| InChIKey | BFZNMUGAZYAMTG-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl-2-nonynoate
Property Insights of Ethyl-2-nonynoate
The XLogP value of 4.1 indicates that Ethyl-2-nonynoate 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-nonynoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl-2-nonynoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl-2-nonynoate?
The CAS number of Ethyl-2-nonynoate is 10031-92-2.
What is the molecular formula of Ethyl-2-nonynoate?
The molecular formula of Ethyl-2-nonynoate is C11H18O2.
What is the molecular weight of Ethyl-2-nonynoate?
The molecular weight of Ethyl-2-nonynoate is 182.13068 g/mol.
Where can I buy Ethyl-2-nonynoate?
You can request a quote for Ethyl-2-nonynoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl-2-nonynoate?
Yes, CoreyChem provides custom synthesis services for Ethyl-2-nonynoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.