3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide
TL;DR: 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide (CAS 22041-33-4) is a chemical compound with molecular formula C9H20INO2 and molecular weight 301.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-ethoxy-3-oxopropyl)-ethyl-dimethylazanium iodide
Also Known As: (2-Carboxyethyl)dimethylethylammonium iodide ethyl ester, (3-ethoxy-3-oxopropyl)-ethyl-dimethylazanium iodide, (3-ethoxy-3-oxopropyl)-ethyl-dimethylazanium,iodide, 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide, AMMONIUM, (2-CARBOXYETHYL)DIMETHYLETHYL-, IODIDE, ETHYL ESTER
| Molecular Formula | C9H20INO2 |
|---|---|
| Molecular Weight | 301.05 g/mol |
| LogP | -1.96 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 301.0539 |
| Heavy Atoms | 13 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 22041-33-4 |
|---|---|
| SMILES | CC[N+](C)(C)CCC(=O)OCC.[I-] |
| InChIKey | JWLGFNCHLIRLEE-UHFFFAOYSA-M |
Product Overview
3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide (CAS 22041-33-4), with molecular formula C9H20INO2 and molecular weight 301.05 g/mol. IUPAC: (3-ethoxy-3-oxopropyl)-ethyl-dimethylazanium iodide.
Chemical Property Profile of 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide
Property Insights of 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide
The XLogP value of -1.96 indicates that 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide 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, 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide 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 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide?
The CAS number of 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide is 22041-33-4.
What is the molecular formula of 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide?
The molecular formula of 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide is C9H20INO2.
What is the molecular weight of 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide?
The molecular weight of 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide is 301.05 g/mol.
Where can I buy 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide?
You can request a quote for 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethoxy-N-ethyl-N,N-dimethyl-3-oxopropan-1-aminium iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.