1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene
TL;DR: 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene (CAS 5739-95-7) is a chemical compound with molecular formula C12H5Cl4NO3 and molecular weight 350.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene
Also Known As: 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene, 2-chloro-4-nitrophenyl 2,4,5-trichlorophenyl ether, 2-chloro-4-nitro-1-(2,4,5-trichlorophenoxy)benzene, Benzene,1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)-, RefChem:382201
| Molecular Formula | C12H5Cl4NO3 |
|---|---|
| Molecular Weight | 350.90 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 350.90234 |
| Heavy Atoms | 20 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 5739-95-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])Cl)OC2=CC(=C(C=C2Cl)Cl)Cl |
| InChIKey | LIIULZDLMHLVOS-UHFFFAOYSA-N |
Product Overview
1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene (CAS 5739-95-7), with molecular formula C12H5Cl4NO3 and molecular weight 350.90 g/mol. IUPAC: 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene.
Chemical Property Profile of 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene
Property Insights of 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene
The XLogP value of 5.9 indicates that 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.1 Ų, 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene 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 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene?
The CAS number of 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene is 5739-95-7.
What is the molecular formula of 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene?
The molecular formula of 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene is C12H5Cl4NO3.
What is the molecular weight of 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene?
The molecular weight of 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene is 350.90 g/mol.
Where can I buy 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene?
You can request a quote for 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4-trichloro-5-(2-chloro-4-nitrophenoxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.