Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride
TL;DR: Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride (CAS 51441-48-6) is a chemical compound with molecular formula C16H24ClNO2 and molecular weight 297.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-diethyl-(2-prop-2-enoyloxyethyl)azanium chloride
Also Known As: EINECS 257-206-0, Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride, benzyldiethyl[2-[oxy]ethyl]ammoniumchloride, benzyldiethyl[2-[ oxy]ethyl]ammoniumchloride, benzyl-diethyl-(2-prop-2-enoyloxyethyl)azanium chloride
| Molecular Formula | C16H24ClNO2 |
|---|---|
| Molecular Weight | 297.15 g/mol |
| LogP | -0.2236 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 297.14957 |
| Heavy Atoms | 20 |
| Complexity | 402.19772 |
Chemical Identifiers
| CAS Number | 51441-48-6 |
|---|---|
| SMILES | CC[N+](CC)(CCOC(=O)C=C)CC1=CC=CC=C1.[Cl-] |
Product Overview
Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride (CAS 51441-48-6), with molecular formula C16H24ClNO2 and molecular weight 297.15 g/mol. IUPAC: benzyl-diethyl-(2-prop-2-enoyloxyethyl)azanium chloride.
Chemical Property Profile of Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride
Property Insights of Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride
The XLogP value of -0.2236 indicates that Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 26.3 Ų, Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride has 0 hydrogen bond donor(s) and 2 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 Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride?
The CAS number of Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride is 51441-48-6.
What is the molecular formula of Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride?
The molecular formula of Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride is C16H24ClNO2.
What is the molecular weight of Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride?
The molecular weight of Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride is 297.15 g/mol.
Where can I buy Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride?
You can request a quote for Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride?
Yes, KEHONG BIO provides custom synthesis services for Benzyldiethyl(2-((1-oxoallyl)oxy)ethyl)ammonium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.