Linalyl octanoate
TL;DR: Linalyl octanoate (CAS 10024-64-3) is a chemical compound with molecular formula C18H32O2 and molecular weight 280.24023 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,7-dimethylocta-1,6-dien-3-yl octanoate
Also Known As: Linalyl octanoate, Linalyl caprylate, Linalyl octoate, Linalylcaprylat, 3,7-dimethylocta-1,6-dien-3-yl octanoate
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H32O2 |
| Molecular Weight | 280.24023 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Exact Mass | 280.24023 Da |
| Heavy Atoms | 20 |
| Complexity | 313.0 |
| Density | 0.877-0.883 |
| Refractive Index | 1.454-1.460 |
| Solubility | insoluble in water; soluble in alcohol |
| SMILES | CCCCCCCC(=O)OC(C)(CCC=C(C)C)C=C |
| InChIKey | OJKMRECJBIPPRG-UHFFFAOYSA-N |
Chemical Property Profile of Linalyl octanoate
Property Insights of Linalyl octanoate
The XLogP value of 6.3 indicates that Linalyl octanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Linalyl octanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Linalyl octanoate 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 Linalyl octanoate?
The CAS number of Linalyl octanoate is 10024-64-3.
What is the molecular formula of Linalyl octanoate?
The molecular formula of Linalyl octanoate is C18H32O2.
What is the molecular weight of Linalyl octanoate?
The molecular weight of Linalyl octanoate is 280.24023 g/mol.
Where can I buy Linalyl octanoate?
You can request a quote for Linalyl octanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Linalyl octanoate?
Yes, CoreyChem provides custom synthesis services for Linalyl octanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.