1-Ethyl-1H-imidazole
TL;DR: 1-Ethyl-1H-imidazole (CAS 7098-07-9) is a chemical compound with molecular formula C5H8N2 and molecular weight 96.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylimidazole
Also Known As: 1-Ethylimidazole, 1-Ethyl-1H-imidazole, N-Ethylimidazole, Imidazole, 1-ethyl-, ethylimidazole
| Molecular Formula | C5H8N2 |
|---|---|
| Molecular Weight | 96.07 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 96.06875 |
| Heavy Atoms | 7 |
| Complexity | 54.0 |
Chemical Identifiers
| CAS Number | 7098-07-9 |
|---|---|
| SMILES | CCN1C=CN=C1 |
| InChIKey | IWDFHWZHHOSSGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Ethyl-1H-imidazole (CAS 7098-07-9), with molecular formula C5H8N2 and molecular weight 96.07 g/mol. IUPAC: 1-ethylimidazole.
Chemical Property Profile of 1-Ethyl-1H-imidazole
Property Insights of 1-Ethyl-1H-imidazole
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-1H-imidazole. With a topological polar surface area (TPSA) of 17.8 Ų, 1-Ethyl-1H-imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-1H-imidazole 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-Ethyl-1H-imidazole?
The CAS number of 1-Ethyl-1H-imidazole is 7098-07-9.
What is the molecular formula of 1-Ethyl-1H-imidazole?
The molecular formula of 1-Ethyl-1H-imidazole is C5H8N2.
What is the molecular weight of 1-Ethyl-1H-imidazole?
The molecular weight of 1-Ethyl-1H-imidazole is 96.07 g/mol.
Where can I buy 1-Ethyl-1H-imidazole?
You can request a quote for 1-Ethyl-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.