![[4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate structure](/static/products/3389/338960-94-4.webp)
[4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate
TL;DR: [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate (CAS 338960-94-4) is a chemical compound with molecular formula C20H12ClF2NO5 and molecular weight 419.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2,4-difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate
Also Known As: 5L-539S, [4-(2,4-difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate, 4-(2,4-difluorophenoxy)-3-nitrobenzyl 3-chlorobenzenecarboxylate, [4-(2,4-difluorophenoxy)-3-nitrophenyl]methyl3-chlorobenzoate, [4-(2,4-difluorophenoxy)-3-nitro-phenyl]methyl 3-chlorobenzoate
| Molecular Formula | C20H12ClF2NO5 |
|---|---|
| Molecular Weight | 419.04 g/mol |
| LogP | 5.6757 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 419.0372 |
| Heavy Atoms | 29 |
| Complexity | 1090.2168 |
Chemical Identifiers
| CAS Number | 338960-94-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)C(=O)OCC2=CC(=C(C=C2)OC3=C(C=C(C=C3)F)F)[N+](=O)[O-] |
Product Overview
[4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate (CAS 338960-94-4), with molecular formula C20H12ClF2NO5 and molecular weight 419.04 g/mol. IUPAC: [4-(2,4-difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate.
Chemical Property Profile of [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate
Property Insights of [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate
The XLogP value of 5.6757 indicates that [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate. Following Lipinski's Rule of Five, [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate?
The CAS number of [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate is 338960-94-4.
What is the molecular formula of [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate?
The molecular formula of [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate is C20H12ClF2NO5.
What is the molecular weight of [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate?
The molecular weight of [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate is 419.04 g/mol.
Where can I buy [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate?
You can request a quote for [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [4-(2,4-Difluorophenoxy)-3-nitrophenyl]methyl 3-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.