1,3-Dimethylimidazolium
TL;DR: 1,3-Dimethylimidazolium (CAS 45470-32-4) is a chemical compound with molecular formula C5H9N2+ and molecular weight 97.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethylimidazol-1-ium
Also Known As: 1,3-dimethylimidazol-1-ium, 1,3-DIMETHYLIMIDAZOLIUM, [dmim], 1,3-dimethyl-1H-imidazol-3-ium, 1,3-Dimethylimidazolium iodide
| Molecular Formula | C5H9N2+ |
|---|---|
| Molecular Weight | 97.08 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 8.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 97.07658 |
| Heavy Atoms | 7 |
| Complexity | 55.0 |
Chemical Identifiers
| CAS Number | 45470-32-4 |
|---|---|
| SMILES | CN1C=C[N+](=C1)C |
| InChIKey | HVVRUQBMAZRKPJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dimethylimidazolium (CAS 45470-32-4), with molecular formula C5H9N2+ and molecular weight 97.08 g/mol. IUPAC: 1,3-dimethylimidazol-1-ium.
Chemical Property Profile of 1,3-Dimethylimidazolium
Property Insights of 1,3-Dimethylimidazolium
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dimethylimidazolium. With a topological polar surface area (TPSA) of 8.8 Ų, 1,3-Dimethylimidazolium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dimethylimidazolium has 0 hydrogen bond donor(s) and 0 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?
The CAS number of 1,3-Dimethylimidazolium is 45470-32-4.
What is the molecular formula of 1,3-Dimethylimidazolium?
The molecular formula of 1,3-Dimethylimidazolium is C5H9N2+.
What is the molecular weight of 1,3-Dimethylimidazolium?
The molecular weight of 1,3-Dimethylimidazolium is 97.08 g/mol.
Where can I buy 1,3-Dimethylimidazolium?
You can request a quote for 1,3-Dimethylimidazolium 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?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dimethylimidazolium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.