Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol
TL;DR: Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol (CAS 56728-12-2) is a chemical compound with molecular formula C18H9F15O7 and molecular weight 622.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[3-methoxy-4-(2,2,3,3,3-pentafluoropropanoyloxy)phenyl]-2-(2,2,3,3,3-pentafluoropropanoyloxy)ethyl] 2,2,3,3,3-pentafluoropropanoate
Also Known As: 4-Hydroxy-3-methoxyphenethylene glycol tripfp, Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol, 4-Hydroxy-3-methoxyphenyl-1,2-ethanediol,tris(pentafluoropropanoate)(ester), Propanoic acid, pentafluoro-, 1-[3-methoxy-4-(2,2,3,3,3-pentafluoro-1-oxopropoxy)phenyl]-1,2-ethanediyl ester, [2-[3-methoxy-4-(2,2,3,3,3-pentafluoropropanoyloxy)phenyl]-2-(2,2,3,3,3-pentafluoropropanoyloxy)ethyl] 2,2,3,3,3-pentafluoropropanoate
| Molecular Formula | C18H9F15O7 |
|---|---|
| Molecular Weight | 622.01 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 12 |
| Exact Mass | 622.01086 |
| Heavy Atoms | 40 |
| Complexity | 926.0 |
Chemical Identifiers
| CAS Number | 56728-12-2 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(COC(=O)C(C(F)(F)F)(F)F)OC(=O)C(C(F)(F)F)(F)F)OC(=O)C(C(F)(F)F)(F)F |
| InChIKey | IBBPTMDXVHITSG-UHFFFAOYSA-N |
Product Overview
Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol (CAS 56728-12-2), with molecular formula C18H9F15O7 and molecular weight 622.01 g/mol. IUPAC: [2-[3-methoxy-4-(2,2,3,3,3-pentafluoropropanoyloxy)phenyl]-2-(2,2,3,3,3-pentafluoropropanoyloxy)ethyl] 2,2,3,3,3-pentafluoropropanoate.
Chemical Property Profile of Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol
Property Insights of Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol
The XLogP value of 6.6 indicates that Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol. Following Lipinski's Rule of Five, Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol has 0 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol?
The CAS number of Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol is 56728-12-2.
What is the molecular formula of Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol?
The molecular formula of Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol is C18H9F15O7.
What is the molecular weight of Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol?
The molecular weight of Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol is 622.01 g/mol.
Where can I buy Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol?
You can request a quote for Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol?
Yes, KEHONG BIO provides custom synthesis services for Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.