Perfluoro-3,6-dioxadecanoic acid
TL;DR: Perfluoro-3,6-dioxadecanoic acid (CAS 137780-69-9) is a chemical compound with molecular formula C8HF15O4 and molecular weight 445.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-(1,1,2,2,3,3,4,4,4-nonafluorobutoxy)ethoxy]acetic acid
Also Known As: Perfluoro-3,6-dioxadecanoic acid, C8HF15O4, 1-(2-Bromophenyl)-2-thiourea, 4057AD, 4-(Trifluoromethyl)phenylboronic acid
| Molecular Formula | C8HF15O4 |
|---|---|
| Molecular Weight | 445.96 g/mol |
| LogP | 4.3083 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 445.96353 |
| Heavy Atoms | 27 |
| Complexity | 564.6544 |
Chemical Identifiers
| CAS Number | 137780-69-9 |
|---|---|
| SMILES | C(=O)(C(OC(C(OC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O |
Product Overview
Perfluoro-3,6-dioxadecanoic acid (CAS 137780-69-9), with molecular formula C8HF15O4 and molecular weight 445.96 g/mol. IUPAC: 2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-(1,1,2,2,3,3,4,4,4-nonafluorobutoxy)ethoxy]acetic acid.
Chemical Property Profile of Perfluoro-3,6-dioxadecanoic acid
Property Insights of Perfluoro-3,6-dioxadecanoic acid
The XLogP value of 4.3083 indicates that Perfluoro-3,6-dioxadecanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.76 Ų, Perfluoro-3,6-dioxadecanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Perfluoro-3,6-dioxadecanoic acid has 1 hydrogen bond donor(s) and 3 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 Perfluoro-3,6-dioxadecanoic acid?
The CAS number of Perfluoro-3,6-dioxadecanoic acid is 137780-69-9.
What is the molecular formula of Perfluoro-3,6-dioxadecanoic acid?
The molecular formula of Perfluoro-3,6-dioxadecanoic acid is C8HF15O4.
What is the molecular weight of Perfluoro-3,6-dioxadecanoic acid?
The molecular weight of Perfluoro-3,6-dioxadecanoic acid is 445.96 g/mol.
Where can I buy Perfluoro-3,6-dioxadecanoic acid?
You can request a quote for Perfluoro-3,6-dioxadecanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perfluoro-3,6-dioxadecanoic acid?
Yes, KEHONG BIO provides custom synthesis services for Perfluoro-3,6-dioxadecanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.