5-Ethynyl-1-methyl-1H-imidazole
TL;DR: 5-Ethynyl-1-methyl-1H-imidazole (CAS 71759-92-7) is a chemical compound with molecular formula C6H6N2 and molecular weight 106.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethynyl-1-methylimidazole
Also Known As: 5-Ethynyl-1-methyl-1H-imidazole, null, 5-ethynyl-1-methylimidazole, N-Cbz-dl-serine, 5-ethynyl-1-methyl-imidazole
| Molecular Formula | C6H6N2 |
|---|---|
| Molecular Weight | 106.05 g/mol |
| LogP | 0.4014 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 106.0531 |
| Heavy Atoms | 8 |
| Complexity | 216.67757 |
Chemical Identifiers
| CAS Number | 71759-92-7 |
|---|---|
| SMILES | CN1C=NC=C1C#C |
Product Overview
5-Ethynyl-1-methyl-1H-imidazole (CAS 71759-92-7), with molecular formula C6H6N2 and molecular weight 106.05 g/mol. IUPAC: 5-ethynyl-1-methylimidazole.
Chemical Property Profile of 5-Ethynyl-1-methyl-1H-imidazole
Property Insights of 5-Ethynyl-1-methyl-1H-imidazole
The XLogP value of 0.4014 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethynyl-1-methyl-1H-imidazole. With a topological polar surface area (TPSA) of 17.82 Ų, 5-Ethynyl-1-methyl-1H-imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethynyl-1-methyl-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 5-Ethynyl-1-methyl-1H-imidazole?
The CAS number of 5-Ethynyl-1-methyl-1H-imidazole is 71759-92-7.
What is the molecular formula of 5-Ethynyl-1-methyl-1H-imidazole?
The molecular formula of 5-Ethynyl-1-methyl-1H-imidazole is C6H6N2.
What is the molecular weight of 5-Ethynyl-1-methyl-1H-imidazole?
The molecular weight of 5-Ethynyl-1-methyl-1H-imidazole is 106.05 g/mol.
Where can I buy 5-Ethynyl-1-methyl-1H-imidazole?
You can request a quote for 5-Ethynyl-1-methyl-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethynyl-1-methyl-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethynyl-1-methyl-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.