1,3-Dimethylimidazolium Iodide
TL;DR: 1,3-Dimethylimidazolium Iodide (CAS 4333-62-4) is a chemical compound with molecular formula C5H9IN2 and molecular weight 223.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethylimidazol-1-ium iodide
Also Known As: 1,3-Dimethylimidazolium iodide, 1,3-dimethyl-1H-imidazol-3-ium iodide, Bromocyclopropane, 1-Methylimidazole methiodide, 1,3-dimethylimidazol-1-ium iodide
| Molecular Formula | C5H9IN2 |
|---|---|
| Molecular Weight | 223.98 g/mol |
| LogP | -3.15 |
| Topological Polar Surface Area | 8.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 223.98105 |
| Heavy Atoms | 8 |
| Complexity | 55.0 |
Chemical Identifiers
| CAS Number | 4333-62-4 |
|---|---|
| SMILES | CN1C=C[N+](=C1)C.[I-] |
| InChIKey | ARSMIBSHEYKMJT-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dimethylimidazolium Iodide (CAS 4333-62-4), with molecular formula C5H9IN2 and molecular weight 223.98 g/mol. IUPAC: 1,3-dimethylimidazol-1-ium iodide.
Chemical Property Profile of 1,3-Dimethylimidazolium Iodide
Property Insights of 1,3-Dimethylimidazolium Iodide
The XLogP value of -3.15 indicates that 1,3-Dimethylimidazolium Iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 8.8 Ų, 1,3-Dimethylimidazolium Iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dimethylimidazolium Iodide has 0 hydrogen bond donor(s) and 1 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 1,3-Dimethylimidazolium Iodide?
The CAS number of 1,3-Dimethylimidazolium Iodide is 4333-62-4.
What is the molecular formula of 1,3-Dimethylimidazolium Iodide?
The molecular formula of 1,3-Dimethylimidazolium Iodide is C5H9IN2.
What is the molecular weight of 1,3-Dimethylimidazolium Iodide?
The molecular weight of 1,3-Dimethylimidazolium Iodide is 223.98 g/mol.
Where can I buy 1,3-Dimethylimidazolium Iodide?
You can request a quote for 1,3-Dimethylimidazolium Iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dimethylimidazolium Iodide?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dimethylimidazolium Iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.