1,3-Bis(1-methylethyl)-1H-imidazolium
TL;DR: 1,3-Bis(1-methylethyl)-1H-imidazolium (CAS 94592-89-9) is a chemical compound with molecular formula C9H17N2+ and molecular weight 153.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-di(propan-2-yl)imidazol-1-ium
Also Known As: 1,3-di(propan-2-yl)imidazol-1-ium, 1,3-Diisopropyl-1H-imidazole-3-ium, 1,3-Diisopropyl-3H-imidazole-1-ium, 1,3-Bisisopropyl-1H-imidazole-3-ium, 1,3-Diisopropyl-4-imidazoline-2-ylium
| Molecular Formula | C9H17N2+ |
|---|---|
| Molecular Weight | 153.14 g/mol |
| LogP | 1.9374 |
| Topological Polar Surface Area | 8.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 153.13918 |
| Heavy Atoms | 11 |
| Complexity | 200.72153 |
Chemical Identifiers
| CAS Number | 94592-89-9 |
|---|---|
| SMILES | CC(C)N1C=C[N+](=C1)C(C)C |
Product Overview
1,3-Bis(1-methylethyl)-1H-imidazolium (CAS 94592-89-9), with molecular formula C9H17N2+ and molecular weight 153.14 g/mol. IUPAC: 1,3-di(propan-2-yl)imidazol-1-ium.
Chemical Property Profile of 1,3-Bis(1-methylethyl)-1H-imidazolium
Property Insights of 1,3-Bis(1-methylethyl)-1H-imidazolium
The XLogP value of 1.9374 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Bis(1-methylethyl)-1H-imidazolium. With a topological polar surface area (TPSA) of 8.81 Ų, 1,3-Bis(1-methylethyl)-1H-imidazolium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Bis(1-methylethyl)-1H-imidazolium 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-Bis(1-methylethyl)-1H-imidazolium?
The CAS number of 1,3-Bis(1-methylethyl)-1H-imidazolium is 94592-89-9.
What is the molecular formula of 1,3-Bis(1-methylethyl)-1H-imidazolium?
The molecular formula of 1,3-Bis(1-methylethyl)-1H-imidazolium is C9H17N2+.
What is the molecular weight of 1,3-Bis(1-methylethyl)-1H-imidazolium?
The molecular weight of 1,3-Bis(1-methylethyl)-1H-imidazolium is 153.14 g/mol.
Where can I buy 1,3-Bis(1-methylethyl)-1H-imidazolium?
You can request a quote for 1,3-Bis(1-methylethyl)-1H-imidazolium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis(1-methylethyl)-1H-imidazolium?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis(1-methylethyl)-1H-imidazolium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.