Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate
TL;DR: Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate (CAS 63101-12-2) is a chemical compound with molecular formula C14H29NO6S and molecular weight 339.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl sulfate;triethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium
Also Known As: EINECS 263-855-0, Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate, TRIETHYL[2-[(2-METHYL-1-OXOALLYL)OXY]ETHYL]AMMONIUM ETHYL SULPHATE, ethyl sulfate,triethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium, ethyl sulfate; triethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium
| Molecular Formula | C14H29NO6S |
|---|---|
| Molecular Weight | 339.17 g/mol |
| LogP | 1.4653 |
| Topological Polar Surface Area | 92.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 339.17157 |
| Heavy Atoms | 22 |
| Complexity | 420.34937 |
Chemical Identifiers
| CAS Number | 63101-12-2 |
|---|---|
| SMILES | CC[N+](CC)(CC)CCOC(=O)C(=C)C.CCOS(=O)(=O)[O-] |
Product Overview
Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate (CAS 63101-12-2), with molecular formula C14H29NO6S and molecular weight 339.17 g/mol. IUPAC: ethyl sulfate;triethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium.
Chemical Property Profile of Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate
Property Insights of Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate
The XLogP value of 1.4653 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate. The TPSA of 92.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate. Following Lipinski's Rule of Five, Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate has 0 hydrogen bond donor(s) and 6 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 Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate?
The CAS number of Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate is 63101-12-2.
What is the molecular formula of Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate?
The molecular formula of Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate is C14H29NO6S.
What is the molecular weight of Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate?
The molecular weight of Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate is 339.17 g/mol.
Where can I buy Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate?
You can request a quote for Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate?
Yes, KEHONG BIO provides custom synthesis services for Triethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium ethyl sulphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.