Ethyl 11H-perfluoroundecanoate
TL;DR: Ethyl 11H-perfluoroundecanoate (CAS 1649-56-5) is a chemical compound with molecular formula C13H6F20O2 and molecular weight 574.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-icosafluoroundecanoate
Also Known As: Ethyl 11H-perfluoroundecanoate, Ethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-icosafluoroundecanoate, 5296AD, I14-38962, Undecanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-eicosafluoro-, ethyl ester
| Molecular Formula | C13H6F20O2 |
|---|---|
| Molecular Weight | 574.00 g/mol |
| LogP | 6.5323 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 574.0048 |
| Heavy Atoms | 35 |
| Complexity | 783.8884 |
Chemical Identifiers
| CAS Number | 1649-56-5 |
|---|---|
| SMILES | CCOC(=O)C(C(C(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
Product Overview
Ethyl 11H-perfluoroundecanoate (CAS 1649-56-5), with molecular formula C13H6F20O2 and molecular weight 574.00 g/mol. IUPAC: ethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-icosafluoroundecanoate.
Chemical Property Profile of Ethyl 11H-perfluoroundecanoate
Property Insights of Ethyl 11H-perfluoroundecanoate
The XLogP value of 6.5323 indicates that Ethyl 11H-perfluoroundecanoate 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 11H-perfluoroundecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 11H-perfluoroundecanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 11H-perfluoroundecanoate?
The CAS number of Ethyl 11H-perfluoroundecanoate is 1649-56-5.
What is the molecular formula of Ethyl 11H-perfluoroundecanoate?
The molecular formula of Ethyl 11H-perfluoroundecanoate is C13H6F20O2.
What is the molecular weight of Ethyl 11H-perfluoroundecanoate?
The molecular weight of Ethyl 11H-perfluoroundecanoate is 574.00 g/mol.
Where can I buy Ethyl 11H-perfluoroundecanoate?
You can request a quote for Ethyl 11H-perfluoroundecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 11H-perfluoroundecanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 11H-perfluoroundecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.