5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline
TL;DR: 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline (CAS 94094-38-9) is a chemical compound with molecular formula C16H16Cl2N2O3 and molecular weight 354.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline
Also Known As: EINECS 302-139-5, 3,3'-Diaminodiphenylmethane, 5-Chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline, N1,N1-diethyl-5-chloro-2-(4-chlorophenoxy)-4-nitroaniline, 5-Chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitrobenzenamine
| Molecular Formula | C16H16Cl2N2O3 |
|---|---|
| Molecular Weight | 354.05 g/mol |
| LogP | 5.5401 |
| Topological Polar Surface Area | 55.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 354.0538 |
| Heavy Atoms | 23 |
| Complexity | 701.2167 |
Chemical Identifiers
| CAS Number | 94094-38-9 |
|---|---|
| SMILES | CCN(CC)C1=CC(=C(C=C1OC2=CC=C(C=C2)Cl)[N+](=O)[O-])Cl |
Product Overview
5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline (CAS 94094-38-9), with molecular formula C16H16Cl2N2O3 and molecular weight 354.05 g/mol. IUPAC: 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline.
Chemical Property Profile of 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline
Property Insights of 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline
The XLogP value of 5.5401 indicates that 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.61 Ų, 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline?
The CAS number of 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline is 94094-38-9.
What is the molecular formula of 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline?
The molecular formula of 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline is C16H16Cl2N2O3.
What is the molecular weight of 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline?
The molecular weight of 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline is 354.05 g/mol.
Where can I buy 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline?
You can request a quote for 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-2-(4-chlorophenoxy)-N,N-diethyl-4-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.