Decanoic acid, 10-fluoro-, 2-fluoroethyl ester
TL;DR: Decanoic acid, 10-fluoro-, 2-fluoroethyl ester (CAS 591-74-2) is a chemical compound with molecular formula C12H22F2O2 and molecular weight 236.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoroethyl 10-fluorodecanoate
Also Known As: 2-fluoroethyl 10-fluorodecanoate, 2'-Fluoroethyl 10-fluorodecanoate, 2'-Fluoroethyl omega-fluorodecanoate, Decanoic acid, 10-fluoro-, 2-fluoroethyl ester, 3-02-00-00846 (Beilstein Handbook Reference)
| Molecular Formula | C12H22F2O2 |
|---|---|
| Molecular Weight | 236.16 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 236.15878 |
| Heavy Atoms | 16 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 591-74-2 |
|---|---|
| SMILES | C(CCCCC(=O)OCCF)CCCCF |
| InChIKey | ZUHZQTHCYZBUHF-UHFFFAOYSA-N |
Product Overview
Decanoic acid, 10-fluoro-, 2-fluoroethyl ester (CAS 591-74-2), with molecular formula C12H22F2O2 and molecular weight 236.16 g/mol. IUPAC: 2-fluoroethyl 10-fluorodecanoate.
Chemical Property Profile of Decanoic acid, 10-fluoro-, 2-fluoroethyl ester
Property Insights of Decanoic acid, 10-fluoro-, 2-fluoroethyl ester
The XLogP value of 4.0 indicates that Decanoic acid, 10-fluoro-, 2-fluoroethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Decanoic acid, 10-fluoro-, 2-fluoroethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Decanoic acid, 10-fluoro-, 2-fluoroethyl ester has 0 hydrogen bond donor(s) and 4 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 Decanoic acid, 10-fluoro-, 2-fluoroethyl ester?
The CAS number of Decanoic acid, 10-fluoro-, 2-fluoroethyl ester is 591-74-2.
What is the molecular formula of Decanoic acid, 10-fluoro-, 2-fluoroethyl ester?
The molecular formula of Decanoic acid, 10-fluoro-, 2-fluoroethyl ester is C12H22F2O2.
What is the molecular weight of Decanoic acid, 10-fluoro-, 2-fluoroethyl ester?
The molecular weight of Decanoic acid, 10-fluoro-, 2-fluoroethyl ester is 236.16 g/mol.
Where can I buy Decanoic acid, 10-fluoro-, 2-fluoroethyl ester?
You can request a quote for Decanoic acid, 10-fluoro-, 2-fluoroethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decanoic acid, 10-fluoro-, 2-fluoroethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Decanoic acid, 10-fluoro-, 2-fluoroethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.