3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether
TL;DR: 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether (CAS 80844-10-6) is a chemical compound with molecular formula C23H21ClF2O2 and molecular weight 402.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-fluoro-4-[1-[[3-(4-fluorophenoxy)phenyl]methoxy]-2-methylpropan-2-yl]benzene
Also Known As: 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether, Benzene, 1-((2-(3-chloro-4-fluorophenyl)-2-methylpropoxy)methyl)-3-(4-fluorophenoxy)-, 1-((2-(3-Chloro-4-fluorophenyl)-2-methylpropoxy)methyl)-3-(4-fluorophenoxy)benzene, 2-Chloro-1-fluoro-4-(1-{[3-(4-fluorophenoxy)phenyl]methoxy}-2-methylpropan-2-yl)benzene, 2-chloro-1-fluoro-4-[1-[[3-(4-fluorophenoxy)phenyl]methoxy]-2-methylpropan-2-yl]benzene
| Molecular Formula | C23H21ClF2O2 |
|---|---|
| Molecular Weight | 402.12 g/mol |
| LogP | 6.9049 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 402.1198 |
| Heavy Atoms | 28 |
| Complexity | 939.5873 |
Chemical Identifiers
| CAS Number | 80844-10-6 |
|---|---|
| SMILES | CC(C)(COCC1=CC(=CC=C1)OC2=CC=C(C=C2)F)C3=CC(=C(C=C3)F)Cl |
Product Overview
3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether (CAS 80844-10-6), with molecular formula C23H21ClF2O2 and molecular weight 402.12 g/mol. IUPAC: 2-chloro-1-fluoro-4-[1-[[3-(4-fluorophenoxy)phenyl]methoxy]-2-methylpropan-2-yl]benzene.
Chemical Property Profile of 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether
Property Insights of 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether
The XLogP value of 6.9049 indicates that 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.46 Ų, 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether?
The CAS number of 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether is 80844-10-6.
What is the molecular formula of 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether?
The molecular formula of 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether is C23H21ClF2O2.
What is the molecular weight of 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether?
The molecular weight of 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether is 402.12 g/mol.
Where can I buy 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether?
You can request a quote for 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Fluorophenoxy)benzyl 2-(3-chloro-4-fluorophenyl)-2-methylpropyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.