Ethyl 8-fluoro-4-methyloctanoate
TL;DR: Ethyl 8-fluoro-4-methyloctanoate (CAS 170798-84-2) is a chemical compound with molecular formula C11H21FO2 and molecular weight 204.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 8-fluoro-4-methyloctanoate
Also Known As: ethyl 8-fluoro-4-methyloctanoate, Ethyl 8-fluoro-4-methyl-octanoate
| Molecular Formula | C11H21FO2 |
|---|---|
| Molecular Weight | 204.15 g/mol |
| LogP | 3.1056 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 204.15256 |
| Heavy Atoms | 14 |
| Complexity | 148.22296 |
Chemical Identifiers
| CAS Number | 170798-84-2 |
|---|---|
| SMILES | CCOC(=O)CCC(C)CCCCF |
Product Overview
Ethyl 8-fluoro-4-methyloctanoate (CAS 170798-84-2), with molecular formula C11H21FO2 and molecular weight 204.15 g/mol. IUPAC: ethyl 8-fluoro-4-methyloctanoate.
Chemical Property Profile of Ethyl 8-fluoro-4-methyloctanoate
Property Insights of Ethyl 8-fluoro-4-methyloctanoate
The XLogP value of 3.1056 indicates that Ethyl 8-fluoro-4-methyloctanoate 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 8-fluoro-4-methyloctanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 8-fluoro-4-methyloctanoate 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
Frequently Asked Questions
What is the CAS number of Ethyl 8-fluoro-4-methyloctanoate?
The CAS number of Ethyl 8-fluoro-4-methyloctanoate is 170798-84-2.
What is the molecular formula of Ethyl 8-fluoro-4-methyloctanoate?
The molecular formula of Ethyl 8-fluoro-4-methyloctanoate is C11H21FO2.
What is the molecular weight of Ethyl 8-fluoro-4-methyloctanoate?
The molecular weight of Ethyl 8-fluoro-4-methyloctanoate is 204.15 g/mol.
Where can I buy Ethyl 8-fluoro-4-methyloctanoate?
You can request a quote for Ethyl 8-fluoro-4-methyloctanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 8-fluoro-4-methyloctanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 8-fluoro-4-methyloctanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.