![N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline structure](/static/products/5418/54186-00-4.webp)
N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline
TL;DR: N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline (CAS 54186-00-4) is a chemical compound with molecular formula C18H17Cl2NO and molecular weight 333.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(2,4-dichlorophenoxy)but-2-ynyl]-N-ethylaniline
Also Known As: N-[4-(2,4-dichlorophenoxy)but-2-ynyl]-N-ethylaniline, N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline
| Molecular Formula | C18H17Cl2NO |
|---|---|
| Molecular Weight | 333.07 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.06873 |
| Heavy Atoms | 22 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 54186-00-4 |
|---|---|
| SMILES | CCN(CC#CCOC1=C(C=C(C=C1)Cl)Cl)C2=CC=CC=C2 |
| InChIKey | XWWIWPRVLMHUCT-UHFFFAOYSA-N |
Product Overview
N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline (CAS 54186-00-4), with molecular formula C18H17Cl2NO and molecular weight 333.07 g/mol. IUPAC: N-[4-(2,4-dichlorophenoxy)but-2-ynyl]-N-ethylaniline.
Chemical Property Profile of N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline
Property Insights of N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline
The XLogP value of 5.4 indicates that N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline?
The CAS number of N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline is 54186-00-4.
What is the molecular formula of N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline?
The molecular formula of N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline is C18H17Cl2NO.
What is the molecular weight of N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline?
The molecular weight of N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline is 333.07 g/mol.
Where can I buy N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline?
You can request a quote for N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(2,4-Dichlorophenoxy)but-2-yn-1-yl]-N-ethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.