4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole
TL;DR: 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole (CAS 6969-36-4) is a chemical compound with molecular formula C7H10N2 and molecular weight 122.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-1-prop-2-enylimidazole
Also Known As: 1-allyl-4-methyl-1H-imidazole, 4-methyl-1-(prop-2-en-1-yl)-1h-imidazole, 4-methyl-1-prop-2-enylimidazole, 1H-Imidazole, 4-methyl-1-(2-propen-1-yl)-, J3.502.447F
| Molecular Formula | C7H10N2 |
|---|---|
| Molecular Weight | 122.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 122.0844 |
| Heavy Atoms | 9 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 6969-36-4 |
|---|---|
| SMILES | CC1=CN(C=N1)CC=C |
| InChIKey | CCCXEUIYYWUDID-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole (CAS 6969-36-4), with molecular formula C7H10N2 and molecular weight 122.08 g/mol. IUPAC: 4-methyl-1-prop-2-enylimidazole.
Chemical Property Profile of 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole
Property Insights of 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole. With a topological polar surface area (TPSA) of 17.8 Ų, 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-1-(prop-2-en-1-yl)-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 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole?
The CAS number of 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole is 6969-36-4.
What is the molecular formula of 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole?
The molecular formula of 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole is C7H10N2.
What is the molecular weight of 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole?
The molecular weight of 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole is 122.08 g/mol.
Where can I buy 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole?
You can request a quote for 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-1-(prop-2-en-1-yl)-1h-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.