![2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate structure](/static/products/5721/5721-79-9.webp)
2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate
TL;DR: 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate (CAS 5721-79-9) is a chemical compound with molecular formula C21H12Cl3NO6 and molecular weight 478.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[4-(2-chloro-6-nitrophenoxy)phenyl]-2-oxoethyl] 3,4-dichlorobenzoate
Also Known As: 2-[4-(2-chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate, [2-[4-(2-chloro-6-nitrophenoxy)phenyl]-2-oxoethyl] 3,4-dichlorobenzoate, [2-[4-(2-chloro-6-nitro-phenoxy)phenyl]-2-oxo-ethyl] 3,4-dichlorobenzoate
| Molecular Formula | C21H12Cl3NO6 |
|---|---|
| Molecular Weight | 478.97 g/mol |
| LogP | 6.387 |
| Topological Polar Surface Area | 95.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 478.97302 |
| Heavy Atoms | 31 |
| Complexity | 1164.2767 |
Chemical Identifiers
| CAS Number | 5721-79-9 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)OC2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-] |
Product Overview
2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate (CAS 5721-79-9), with molecular formula C21H12Cl3NO6 and molecular weight 478.97 g/mol. IUPAC: [2-[4-(2-chloro-6-nitrophenoxy)phenyl]-2-oxoethyl] 3,4-dichlorobenzoate.
Chemical Property Profile of 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate
Property Insights of 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate
The XLogP value of 6.387 indicates that 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate. Following Lipinski's Rule of Five, 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate?
The CAS number of 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate is 5721-79-9.
What is the molecular formula of 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate?
The molecular formula of 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate is C21H12Cl3NO6.
What is the molecular weight of 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate?
The molecular weight of 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate is 478.97 g/mol.
Where can I buy 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate?
You can request a quote for 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(2-Chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3,4-dichlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.