4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene
TL;DR: 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene (CAS 2392-48-5) is a chemical compound with molecular formula C12H6Cl3NO3 and molecular weight 316.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene
Also Known As: 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene, Triclosan Impurity 1, 4-Chloro-1- -2-nitrobenzene, 2,4-dichloro-1-(4-chloro-2-nitrophenoxy)benzene, 2,4,4'-Trichlor-2'-nitro-diphenylether
| Molecular Formula | C12H6Cl3NO3 |
|---|---|
| Molecular Weight | 316.94 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 316.9413 |
| Heavy Atoms | 19 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 2392-48-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)[N+](=O)[O-])OC2=C(C=C(C=C2)Cl)Cl |
| InChIKey | OQMMGSQEZLAGCX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene (CAS 2392-48-5), with molecular formula C12H6Cl3NO3 and molecular weight 316.94 g/mol. IUPAC: 4-chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene.
Chemical Property Profile of 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene
Property Insights of 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene
The XLogP value of 5.3 indicates that 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.1 Ų, 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene?
The CAS number of 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene is 2392-48-5.
What is the molecular formula of 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene?
The molecular formula of 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene is C12H6Cl3NO3.
What is the molecular weight of 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene?
The molecular weight of 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene is 316.94 g/mol.
Where can I buy 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene?
You can request a quote for 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-1-(2,4-dichlorophenoxy)-2-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.