2-Ethylhexyl caprylate
TL;DR: 2-Ethylhexyl caprylate (CAS 63321-70-0) 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.
2-ethylhexyl octanoate
Also Known As: 2-Ethylhexyl octanoate, 2-ethylhexyl caprylate, Octanoic acid, 2-ethylhexyl ester, 2-ethylhexyloctanoate, 2-Ethylhexyl octanoate #
Application Areas
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H32O2 |
| Molecular Weight | 256.24023 g/mol |
| XLogP | 6.2 |
| 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(=O)OCC(CC)CCCC |
| InChIKey | HPUAIVNIHNEYPO-UHFFFAOYSA-N |
Chemical Property Profile of 2-Ethylhexyl caprylate
Property Insights of 2-Ethylhexyl caprylate
The XLogP value of 6.2 indicates that 2-Ethylhexyl caprylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Ethylhexyl caprylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethylhexyl caprylate 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 2-Ethylhexyl caprylate?
The CAS number of 2-Ethylhexyl caprylate is 63321-70-0.
What is the molecular formula of 2-Ethylhexyl caprylate?
The molecular formula of 2-Ethylhexyl caprylate is C16H32O2.
What is the molecular weight of 2-Ethylhexyl caprylate?
The molecular weight of 2-Ethylhexyl caprylate is 256.24023 g/mol.
Where can I buy 2-Ethylhexyl caprylate?
You can request a quote for 2-Ethylhexyl caprylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Ethylhexyl caprylate?
Yes, CoreyChem provides custom synthesis services for 2-Ethylhexyl caprylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.