Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1)
TL;DR: Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1) (CAS 1866-73-5) is a chemical compound with molecular formula C8H18INOS and molecular weight 303.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl(2-propanoylsulfanylethyl)azanium iodide
Also Known As: Propionylthiocholine iodide, s-propionylthiocholine iodide, Ammonium, iodide, propionate, PROPIONYLTHIOCHOLINEIODIDE, (2-Mercaptoethyl)trimethylammonium iodide propionate
| Molecular Formula | C8H18INOS |
|---|---|
| Molecular Weight | 303.02 g/mol |
| LogP | -1.63 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.01538 |
| Heavy Atoms | 12 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 1866-73-5 |
|---|---|
| SMILES | CCC(=O)SCC[N+](C)(C)C.[I-] |
| InChIKey | BJQIXLJDWWVGAE-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1) (CAS 1866-73-5), with molecular formula C8H18INOS and molecular weight 303.02 g/mol. IUPAC: trimethyl(2-propanoylsulfanylethyl)azanium iodide.
Chemical Property Profile of Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1)
Property Insights of Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1)
The XLogP value of -1.63 indicates that Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.4 Ų, Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1) 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 Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1)?
The CAS number of Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1) is 1866-73-5.
What is the molecular formula of Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1)?
The molecular formula of Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1) is C8H18INOS.
What is the molecular weight of Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1)?
The molecular weight of Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1) is 303.02 g/mol.
Where can I buy Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1)?
You can request a quote for Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Ethanaminium, N,N,N-trimethyl-2-((1-oxopropyl)thio)-, iodide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.