Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide
TL;DR: Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide (CAS 59836-87-2) is a chemical compound with molecular formula C11H22BrNO2 and molecular weight 279.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-methyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium bromide
Also Known As: diethylmethyl[2-[oxy]ethyl]ammoniumbromide, diethylmethyl[2-[ oxy]ethyl]ammoniumbromide, Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide, n,n-diethyl-2-(methacryloyloxy)-n-methylethanaminium bromide, diethyl-methyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium bromide
| Molecular Formula | C11H22BrNO2 |
|---|---|
| Molecular Weight | 279.08 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 279.0834 |
| Heavy Atoms | 15 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 59836-87-2 |
|---|---|
| SMILES | CC[N+](C)(CC)CCOC(=O)C(=C)C.[Br-] |
| InChIKey | OVPZVYPVKVHQLZ-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide (CAS 59836-87-2), with molecular formula C11H22BrNO2 and molecular weight 279.08 g/mol. IUPAC: diethyl-methyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium bromide.
Chemical Property Profile of Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide
Property Insights of Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide
The XLogP value of -1.4 indicates that Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide 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, Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide has 0 hydrogen bond donor(s) and 3 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 Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide?
The CAS number of Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide is 59836-87-2.
What is the molecular formula of Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide?
The molecular formula of Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide is C11H22BrNO2.
What is the molecular weight of Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide?
The molecular weight of Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide is 279.08 g/mol.
Where can I buy Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide?
You can request a quote for Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide?
Yes, KEHONG BIO provides custom synthesis services for Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.