![[4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate structure](/static/products/3389/338960-69-3.webp)
[4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate
TL;DR: [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate (CAS 338960-69-3) is a chemical compound with molecular formula C21H15Cl2NO5 and molecular weight 431.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate
Also Known As: 5L-504S, [4-(4-methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate, 4-(4-methylphenoxy)-3-nitrobenzyl 3,4-dichlorobenzenecarboxylate, [4-(4-methylphenoxy)-3-nitrophenyl]methyl3,4-dichlorobenzoate, [4-(4-methylphenoxy)-3-nitro-phenyl]methyl 3,4-dichlorobenzoate
| Molecular Formula | C21H15Cl2NO5 |
|---|---|
| Molecular Weight | 431.03 g/mol |
| LogP | 6.35932 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.0327 |
| Heavy Atoms | 29 |
| Complexity | 1067.1666 |
Chemical Identifiers
| CAS Number | 338960-69-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC2=C(C=C(C=C2)COC(=O)C3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-] |
Product Overview
[4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate (CAS 338960-69-3), with molecular formula C21H15Cl2NO5 and molecular weight 431.03 g/mol. IUPAC: [4-(4-methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate.
Chemical Property Profile of [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate
Property Insights of [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate
The XLogP value of 6.35932 indicates that [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate 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-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate. Following Lipinski's Rule of Five, [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate 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-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate?
The CAS number of [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate is 338960-69-3.
What is the molecular formula of [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate?
The molecular formula of [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate is C21H15Cl2NO5.
What is the molecular weight of [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate?
The molecular weight of [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate is 431.03 g/mol.
Where can I buy [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate?
You can request a quote for [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 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 [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [4-(4-Methylphenoxy)-3-nitrophenyl]methyl 3,4-dichlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.