4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide
TL;DR: 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide (CAS 14548-19-7) is a chemical compound with molecular formula C9H20BrNO3 and molecular weight 269.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R)-4-ethoxy-2-hydroxy-4-oxobutyl]-trimethylazanium bromide
Also Known As: D(+)-Karnitinaethylesterbromid, D(+)-Karnitinaethylesterbromid [German], [(2R)-4-ethoxy-2-hydroxy-4-oxobutyl]-trimethylazanium bromide, (D)-(3-Carboxy-2-hydroxypropyl)trimethylammonium bromide ethyl ester, 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide
| Molecular Formula | C9H20BrNO3 |
|---|---|
| Molecular Weight | 269.06 g/mol |
| LogP | -2.99 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 269.06265 |
| Heavy Atoms | 14 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 14548-19-7 |
|---|---|
| SMILES | CCOC(=O)C[C@H](C[N+](C)(C)C)O.[Br-] |
| InChIKey | JVNNOULEMFYNMO-DDWIOCJRSA-M |
Product Overview
4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide (CAS 14548-19-7), with molecular formula C9H20BrNO3 and molecular weight 269.06 g/mol. IUPAC: [(2R)-4-ethoxy-2-hydroxy-4-oxobutyl]-trimethylazanium bromide.
Chemical Property Profile of 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide
Property Insights of 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide
The XLogP value of -2.99 indicates that 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.5 Ų, 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide has 1 hydrogen bond donor(s) and 4 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-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide?
The CAS number of 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide is 14548-19-7.
What is the molecular formula of 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide?
The molecular formula of 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide is C9H20BrNO3.
What is the molecular weight of 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide?
The molecular weight of 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide is 269.06 g/mol.
Where can I buy 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide?
You can request a quote for 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethoxy-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.