N,N-diethyl-4-(2-phenylethynyl)aniline
TL;DR: N,N-diethyl-4-(2-phenylethynyl)aniline (CAS 150705-07-0) is a chemical compound with molecular formula C18H19N and molecular weight 249.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-4-(2-phenylethynyl)aniline
Also Known As: N,N-diethyl-4-(2-phenylethynyl)aniline, benzenamine, n,n-diethyl-4-(2-phenylethynyl)-
| Molecular Formula | C18H19N |
|---|---|
| Molecular Weight | 249.15 g/mol |
| LogP | 3.9326 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.15175 |
| Heavy Atoms | 19 |
| Complexity | 554.13446 |
Chemical Identifiers
| CAS Number | 150705-07-0 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C#CC2=CC=CC=C2 |
Product Overview
N,N-diethyl-4-(2-phenylethynyl)aniline (CAS 150705-07-0), with molecular formula C18H19N and molecular weight 249.15 g/mol. IUPAC: N,N-diethyl-4-(2-phenylethynyl)aniline.
Chemical Property Profile of N,N-diethyl-4-(2-phenylethynyl)aniline
Property Insights of N,N-diethyl-4-(2-phenylethynyl)aniline
The XLogP value of 3.9326 indicates that N,N-diethyl-4-(2-phenylethynyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, N,N-diethyl-4-(2-phenylethynyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diethyl-4-(2-phenylethynyl)aniline has 0 hydrogen bond donor(s) and 1 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 N,N-diethyl-4-(2-phenylethynyl)aniline?
The CAS number of N,N-diethyl-4-(2-phenylethynyl)aniline is 150705-07-0.
What is the molecular formula of N,N-diethyl-4-(2-phenylethynyl)aniline?
The molecular formula of N,N-diethyl-4-(2-phenylethynyl)aniline is C18H19N.
What is the molecular weight of N,N-diethyl-4-(2-phenylethynyl)aniline?
The molecular weight of N,N-diethyl-4-(2-phenylethynyl)aniline is 249.15 g/mol.
Where can I buy N,N-diethyl-4-(2-phenylethynyl)aniline?
You can request a quote for N,N-diethyl-4-(2-phenylethynyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethyl-4-(2-phenylethynyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-4-(2-phenylethynyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.