Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester
TL;DR: Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester (CAS 55683-24-4) is a chemical compound with molecular formula C15H8F10O6 and molecular weight 474.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-methoxy-2-oxoethyl)-2-(2,2,3,3,3-pentafluoropropanoyloxy)phenyl] 2,2,3,3,3-pentafluoropropanoate
Also Known As: Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester, Methyl ester, pentafluoropropionyl derivative of dihydroxyphenyl acetic acid, [4-(2-Methoxy-2-oxoethyl)-2-(perfluoropropanoyloxy)phenyl] perfluoropropanoate, 3,4-Bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)benzeneacetic acid methyl ester, [4-(2-methoxy-2-oxoethyl)-2-(2,2,3,3,3-pentafluoropropanoyloxy)phenyl] 2,2,3,3,3-pentafluoropropanoate
| Molecular Formula | C15H8F10O6 |
|---|---|
| Molecular Weight | 474.02 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 9 |
| Exact Mass | 474.0161 |
| Heavy Atoms | 31 |
| Complexity | 687.0 |
Chemical Identifiers
| CAS Number | 55683-24-4 |
|---|---|
| SMILES | COC(=O)CC1=CC(=C(C=C1)OC(=O)C(C(F)(F)F)(F)F)OC(=O)C(C(F)(F)F)(F)F |
| InChIKey | BZUPLXRZNYDNRZ-UHFFFAOYSA-N |
Product Overview
Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester (CAS 55683-24-4), with molecular formula C15H8F10O6 and molecular weight 474.02 g/mol. IUPAC: [4-(2-methoxy-2-oxoethyl)-2-(2,2,3,3,3-pentafluoropropanoyloxy)phenyl] 2,2,3,3,3-pentafluoropropanoate.
Chemical Property Profile of Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester
Property Insights of Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester
The XLogP value of 4.8 indicates that Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester. Following Lipinski's Rule of Five, Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester has 0 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester?
The CAS number of Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester is 55683-24-4.
What is the molecular formula of Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester?
The molecular formula of Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester is C15H8F10O6.
What is the molecular weight of Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester?
The molecular weight of Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester is 474.02 g/mol.
Where can I buy Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester?
You can request a quote for Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzeneacetic acid, 3,4-bis(2,2,3,3,3-pentafluoro-1-oxopropoxy)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.