N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium
TL;DR: N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium (CAS 304868-10-8) is a chemical compound with molecular formula C16H22N+ and molecular weight 228.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-(3-phenylprop-2-ynyl)-prop-2-enylazanium
Also Known As: BAS 00391192, diethyl(3-phenylprop-2-ynyl)prop-2-enylamine, Allyl-diethyl-(3-phenyl-prop-2-ynyl)-ammonium, AB01315589-02, diethyl-(3-phenylprop-2-ynyl)-prop-2-enylazanium
| Molecular Formula | C16H22N+ |
|---|---|
| Molecular Weight | 228.18 g/mol |
| LogP | 3.0807 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 228.17523 |
| Heavy Atoms | 17 |
| Complexity | 390.5285 |
Chemical Identifiers
| CAS Number | 304868-10-8 |
|---|---|
| SMILES | CC[N+](CC)(CC=C)CC#CC1=CC=CC=C1 |
Product Overview
N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium (CAS 304868-10-8), with molecular formula C16H22N+ and molecular weight 228.18 g/mol. IUPAC: diethyl-(3-phenylprop-2-ynyl)-prop-2-enylazanium.
Chemical Property Profile of N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium
Property Insights of N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium
The XLogP value of 3.0807 indicates that N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium has 0 hydrogen bond donor(s) and 0 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-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium?
The CAS number of N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium is 304868-10-8.
What is the molecular formula of N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium?
The molecular formula of N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium is C16H22N+.
What is the molecular weight of N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium?
The molecular weight of N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium is 228.18 g/mol.
Where can I buy N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium?
You can request a quote for N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium 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-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-N-(3-phenylprop-2-yn-1-yl)prop-2-en-1-aminium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.