Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester
TL;DR: Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester (CAS 55683-13-1) is a chemical compound with molecular formula C14H8F10O4 and molecular weight 430.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,2,3,3,3-pentafluoropropanoyloxy)-2-phenylethyl] 2,2,3,3,3-pentafluoropropanoate
Also Known As: Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester, Bis(pentafluoropropanoic acid)1-phenyl-1,2-ethanediyl ester, [2-(Perfluoropropanoyloxy)-2-phenylethyl] perfluoropropanoate, 2-[(2,2,3,3,3-Pentafluoropropanoyl)oxy]-1-phenylethyl 2,2,3,3,3-pentafluoropropanoate, [2-(2,2,3,3,3-pentafluoropropanoyloxy)-2-phenylethyl] 2,2,3,3,3-pentafluoropropanoate
| Molecular Formula | C14H8F10O4 |
|---|---|
| Molecular Weight | 430.03 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 8 |
| Exact Mass | 430.02628 |
| Heavy Atoms | 28 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 55683-13-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(COC(=O)C(C(F)(F)F)(F)F)OC(=O)C(C(F)(F)F)(F)F |
| InChIKey | RDPUGQNOTAYRPE-UHFFFAOYSA-N |
Product Overview
Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester (CAS 55683-13-1), with molecular formula C14H8F10O4 and molecular weight 430.03 g/mol. IUPAC: [2-(2,2,3,3,3-pentafluoropropanoyloxy)-2-phenylethyl] 2,2,3,3,3-pentafluoropropanoate.
Chemical Property Profile of Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester
Property Insights of Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester
The XLogP value of 5.1 indicates that Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester has 0 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester?
The CAS number of Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester is 55683-13-1.
What is the molecular formula of Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester?
The molecular formula of Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester is C14H8F10O4.
What is the molecular weight of Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester?
The molecular weight of Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester is 430.03 g/mol.
Where can I buy Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester?
You can request a quote for Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester?
Yes, KEHONG BIO provides custom synthesis services for Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.