1,4-Dichloro-2-(4-nitrophenoxy)benzene
TL;DR: 1,4-Dichloro-2-(4-nitrophenoxy)benzene (CAS 39145-48-7) is a chemical compound with molecular formula C12H7Cl2NO3 and molecular weight 282.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dichloro-2-(4-nitrophenoxy)benzene
Also Known As: 1,4-Dichloro-2-(4-nitrophenoxy)benzene, 1,4-dichloro-2- benzene, 2,5-dichlorophenyl 4-nitrophenyl ether, 2,5-Dichlorophenyl 4'-nitrophenyl ether, Benzene-o-diamine monohydrochloride
| Molecular Formula | C12H7Cl2NO3 |
|---|---|
| Molecular Weight | 282.98 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.9803 |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 39145-48-7 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OC2=C(C=CC(=C2)Cl)Cl |
| InChIKey | UKGBFXVWMSJQQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Dichloro-2-(4-nitrophenoxy)benzene (CAS 39145-48-7), with molecular formula C12H7Cl2NO3 and molecular weight 282.98 g/mol. IUPAC: 1,4-dichloro-2-(4-nitrophenoxy)benzene.
Chemical Property Profile of 1,4-Dichloro-2-(4-nitrophenoxy)benzene
Property Insights of 1,4-Dichloro-2-(4-nitrophenoxy)benzene
The XLogP value of 4.7 indicates that 1,4-Dichloro-2-(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, 1,4-Dichloro-2-(4-nitrophenoxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dichloro-2-(4-nitrophenoxy)benzene has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-Dichloro-2-(4-nitrophenoxy)benzene?
The CAS number of 1,4-Dichloro-2-(4-nitrophenoxy)benzene is 39145-48-7.
What is the molecular formula of 1,4-Dichloro-2-(4-nitrophenoxy)benzene?
The molecular formula of 1,4-Dichloro-2-(4-nitrophenoxy)benzene is C12H7Cl2NO3.
What is the molecular weight of 1,4-Dichloro-2-(4-nitrophenoxy)benzene?
The molecular weight of 1,4-Dichloro-2-(4-nitrophenoxy)benzene is 282.98 g/mol.
Where can I buy 1,4-Dichloro-2-(4-nitrophenoxy)benzene?
You can request a quote for 1,4-Dichloro-2-(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 1,4-Dichloro-2-(4-nitrophenoxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dichloro-2-(4-nitrophenoxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.