2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide
TL;DR: 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide (CAS 33620-52-9) is a chemical compound with molecular formula C8H18BrNO3 and molecular weight 255.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S)-2-hydroxy-4-methoxy-4-oxobutyl]-trimethylazanium bromide
Also Known As: L-(-)-Karnitinmethylesterbromid, L-(-)-Karnitinmethylesterbromid [German], (L)-(3-Carboxy-2-hydroxypropyl)trimethylammonium bromide methyl ester, AMMONIUM, (3-CARBOXY-2-HYDROXYPROPYL)TRIMETHYL-, BROMIDE, METHYL ESTER, (L)-, 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide
| Molecular Formula | C8H18BrNO3 |
|---|---|
| Molecular Weight | 255.05 g/mol |
| LogP | -3.38 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 255.04701 |
| Heavy Atoms | 13 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 33620-52-9 |
|---|---|
| SMILES | C[N+](C)(C)C[C@H](CC(=O)OC)O.[Br-] |
| InChIKey | WAQDCJDFPCWFQK-FJXQXJEOSA-M |
Product Overview
2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide (CAS 33620-52-9), with molecular formula C8H18BrNO3 and molecular weight 255.05 g/mol. IUPAC: [(2S)-2-hydroxy-4-methoxy-4-oxobutyl]-trimethylazanium bromide.
Chemical Property Profile of 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide
Property Insights of 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide
The XLogP value of -3.38 indicates that 2-Hydroxy-4-methoxy-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, 2-Hydroxy-4-methoxy-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, 2-Hydroxy-4-methoxy-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 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide?
The CAS number of 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide is 33620-52-9.
What is the molecular formula of 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide?
The molecular formula of 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide is C8H18BrNO3.
What is the molecular weight of 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide?
The molecular weight of 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide is 255.05 g/mol.
Where can I buy 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide?
You can request a quote for 2-Hydroxy-4-methoxy-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 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-4-methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.