RefChem:1090328
TL;DR: RefChem:1090328 (CAS 108903-57-7) is a chemical compound with molecular formula C13H30I2N2O2 and molecular weight 500.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[2-methyl-4-oxo-4-[2-(trimethylazaniumyl)ethoxy]butan-2-yl]azanium diiodide
Also Known As: NIOSH/EJ4171800, (2-Carboxy-1,1-dimethylethyl)trimethylammonium iodide ester with choline iodide, 2-Trimethylammonioethyl 3-methyl-3-trimethylammoniobutyrate diiodide, Ammonium, (2-carboxy-1,1-dimethylethyl)trimethyl-, iodide, ester with choline iodide, (2-Carboxy-1,1-dimethylethyl)trimethylammonium iodide ester with choli ne iodide
| Molecular Formula | C13H30I2N2O2 |
|---|---|
| Molecular Weight | 500.04 g/mol |
| LogP | -4.88 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 500.03967 |
| Heavy Atoms | 19 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 108903-57-7 |
|---|---|
| SMILES | CC(C)(CC(=O)OCC[N+](C)(C)C)[N+](C)(C)C.[I-].[I-] |
| InChIKey | YSURAYINXNAKRC-UHFFFAOYSA-L |
Product Overview
RefChem:1090328 (CAS 108903-57-7), with molecular formula C13H30I2N2O2 and molecular weight 500.04 g/mol. IUPAC: trimethyl-[2-methyl-4-oxo-4-[2-(trimethylazaniumyl)ethoxy]butan-2-yl]azanium diiodide.
Chemical Property Profile of RefChem:1090328
Property Insights of RefChem:1090328
The XLogP value of -4.88 indicates that RefChem:1090328 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, RefChem:1090328 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1090328 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1090328?
The CAS number of RefChem:1090328 is 108903-57-7.
What is the molecular formula of RefChem:1090328?
The molecular formula of RefChem:1090328 is C13H30I2N2O2.
What is the molecular weight of RefChem:1090328?
The molecular weight of RefChem:1090328 is 500.04 g/mol.
Where can I buy RefChem:1090328?
You can request a quote for RefChem:1090328 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1090328?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1090328 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.