N,N-Diethylethynamine
TL;DR: N,N-Diethylethynamine (CAS 4231-38-3) is a chemical compound with molecular formula C6H11N and molecular weight 97.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-ethynylethanamine
Also Known As: Diethylaminoacetylene, n,n-diethylaminoacetylene, N,N-Diethylethynamine, diethyl(ethynyl)amine, N-ethyl-N-ethynylethanamine
| Molecular Formula | C6H11N |
|---|---|
| Molecular Weight | 97.09 g/mol |
| LogP | 0.9189 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 97.08915 |
| Heavy Atoms | 7 |
| Complexity | 66.73943 |
Chemical Identifiers
| CAS Number | 4231-38-3 |
|---|---|
| SMILES | CCN(CC)C#C |
Product Overview
N,N-Diethylethynamine (CAS 4231-38-3), with molecular formula C6H11N and molecular weight 97.09 g/mol. IUPAC: N-ethyl-N-ethynylethanamine.
Chemical Property Profile of N,N-Diethylethynamine
Property Insights of N,N-Diethylethynamine
The XLogP value of 0.9189 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Diethylethynamine. With a topological polar surface area (TPSA) of 3.24 Ų, N,N-Diethylethynamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diethylethynamine 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-Diethylethynamine?
The CAS number of N,N-Diethylethynamine is 4231-38-3.
What is the molecular formula of N,N-Diethylethynamine?
The molecular formula of N,N-Diethylethynamine is C6H11N.
What is the molecular weight of N,N-Diethylethynamine?
The molecular weight of N,N-Diethylethynamine is 97.09 g/mol.
Where can I buy N,N-Diethylethynamine?
You can request a quote for N,N-Diethylethynamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Diethylethynamine?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diethylethynamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.