4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide
TL;DR: 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide (CAS 109473-98-5) is a chemical compound with molecular formula C14H26INO and molecular weight 351.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-5-butoxypent-4-en-2-ynyl]-diethyl-methylazanium iodide
Also Known As: 5-Butoxy-N,N-diethyl-N-methyl-4-penten-2-yn-1-aminium iodide, 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide, [(E)-5-butoxypent-4-en-2-ynyl]-diethyl-methylazanium iodide, RefChem:1071375
| Molecular Formula | C14H26INO |
|---|---|
| Molecular Weight | 351.11 g/mol |
| LogP | -0.1894 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 351.1059 |
| Heavy Atoms | 17 |
| Complexity | 248.68317 |
Chemical Identifiers
| CAS Number | 109473-98-5 |
|---|---|
| SMILES | CCCCO/C=C/C#CC[N+](C)(CC)CC.[I-] |
Product Overview
4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide (CAS 109473-98-5), with molecular formula C14H26INO and molecular weight 351.11 g/mol. IUPAC: [(E)-5-butoxypent-4-en-2-ynyl]-diethyl-methylazanium iodide.
Chemical Property Profile of 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide
Property Insights of 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide
The XLogP value of -0.1894 indicates that 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 9.23 Ų, 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide 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 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide?
The CAS number of 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide is 109473-98-5.
What is the molecular formula of 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide?
The molecular formula of 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide is C14H26INO.
What is the molecular weight of 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide?
The molecular weight of 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide is 351.11 g/mol.
Where can I buy 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide?
You can request a quote for 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide?
Yes, KEHONG BIO provides custom synthesis services for 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.