2',3',4',5',6'-Pentafluoroacetophenone
TL;DR: 2',3',4',5',6'-Pentafluoroacetophenone (CAS 652-29-9) is a chemical compound with molecular formula C8H3F5O and molecular weight 210.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3,4,5,6-pentafluorophenyl)ethanone
Also Known As: 2',3',4',5',6'-Pentafluoroacetophenone, 1-(Perfluorophenyl)ethanone, Pentafluoroacetophenone, 1-(pentafluorphenyl)ethanon, 1-(2,3,4,5,6-Pentafluorophenyl)ethanone
| Molecular Formula | C8H3F5O |
|---|---|
| Molecular Weight | 210.01 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.0104 |
| Heavy Atoms | 14 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 652-29-9 |
|---|---|
| SMILES | CC(=O)C1=C(C(=C(C(=C1F)F)F)F)F |
| InChIKey | FBGHCYZBCMDEOX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2',3',4',5',6'-Pentafluoroacetophenone (CAS 652-29-9), with molecular formula C8H3F5O and molecular weight 210.01 g/mol. IUPAC: 1-(2,3,4,5,6-pentafluorophenyl)ethanone.
Chemical Property Profile of 2',3',4',5',6'-Pentafluoroacetophenone
Property Insights of 2',3',4',5',6'-Pentafluoroacetophenone
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2',3',4',5',6'-Pentafluoroacetophenone. With a topological polar surface area (TPSA) of 17.1 Ų, 2',3',4',5',6'-Pentafluoroacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2',3',4',5',6'-Pentafluoroacetophenone has 0 hydrogen bond donor(s) and 6 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 2',3',4',5',6'-Pentafluoroacetophenone?
The CAS number of 2',3',4',5',6'-Pentafluoroacetophenone is 652-29-9.
What is the molecular formula of 2',3',4',5',6'-Pentafluoroacetophenone?
The molecular formula of 2',3',4',5',6'-Pentafluoroacetophenone is C8H3F5O.
What is the molecular weight of 2',3',4',5',6'-Pentafluoroacetophenone?
The molecular weight of 2',3',4',5',6'-Pentafluoroacetophenone is 210.01 g/mol.
Where can I buy 2',3',4',5',6'-Pentafluoroacetophenone?
You can request a quote for 2',3',4',5',6'-Pentafluoroacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',3',4',5',6'-Pentafluoroacetophenone?
Yes, KEHONG BIO provides custom synthesis services for 2',3',4',5',6'-Pentafluoroacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.