Perfluorophenyl acetate
TL;DR: Perfluorophenyl acetate (CAS 19220-93-0) is a chemical compound with molecular formula C8H3F5O2 and molecular weight 226.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3,4,5,6-pentafluorophenyl) acetate
Also Known As: Perfluorophenyl acetate, Pentafluorophenyl acetate, Acetic acid pentafluorophenyl ester, (2,3,4,5,6-pentafluorophenyl) acetate, Phenol, pentafluoro-, acetate
| Molecular Formula | C8H3F5O2 |
|---|---|
| Molecular Weight | 226.01 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.00533 |
| Heavy Atoms | 15 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 19220-93-0 |
|---|---|
| SMILES | CC(=O)OC1=C(C(=C(C(=C1F)F)F)F)F |
| InChIKey | ZXTVBLZVILLKPM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Perfluorophenyl acetate (CAS 19220-93-0), with molecular formula C8H3F5O2 and molecular weight 226.01 g/mol. IUPAC: (2,3,4,5,6-pentafluorophenyl) acetate.
Chemical Property Profile of Perfluorophenyl acetate
Property Insights of Perfluorophenyl acetate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Perfluorophenyl acetate. With a topological polar surface area (TPSA) of 26.3 Ų, Perfluorophenyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Perfluorophenyl acetate has 0 hydrogen bond donor(s) and 7 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 Perfluorophenyl acetate?
The CAS number of Perfluorophenyl acetate is 19220-93-0.
What is the molecular formula of Perfluorophenyl acetate?
The molecular formula of Perfluorophenyl acetate is C8H3F5O2.
What is the molecular weight of Perfluorophenyl acetate?
The molecular weight of Perfluorophenyl acetate is 226.01 g/mol.
Where can I buy Perfluorophenyl acetate?
You can request a quote for Perfluorophenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perfluorophenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for Perfluorophenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.