1-But-3-en-2-ylimidazole
TL;DR: 1-But-3-en-2-ylimidazole (CAS 62366-42-1) 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.
1-but-3-en-2-ylimidazole
Also Known As: 1-but-3-en-2-ylimidazole, 1-(but-3-en-2-yl)-1H-imidazole, 1H-Imidazole, 1-(1-methyl-2-propenyl)- (9CI)
| 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 | 62366-42-1 |
|---|---|
| SMILES | CC(C=C)N1C=CN=C1 |
| InChIKey | PXCBDUXMKGCEOG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-But-3-en-2-ylimidazole (CAS 62366-42-1), with molecular formula C7H10N2 and molecular weight 122.08 g/mol. IUPAC: 1-but-3-en-2-ylimidazole.
Chemical Property Profile of 1-But-3-en-2-ylimidazole
Property Insights of 1-But-3-en-2-ylimidazole
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-But-3-en-2-ylimidazole. With a topological polar surface area (TPSA) of 17.8 Ų, 1-But-3-en-2-ylimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-But-3-en-2-ylimidazole 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-But-3-en-2-ylimidazole?
The CAS number of 1-But-3-en-2-ylimidazole is 62366-42-1.
What is the molecular formula of 1-But-3-en-2-ylimidazole?
The molecular formula of 1-But-3-en-2-ylimidazole is C7H10N2.
What is the molecular weight of 1-But-3-en-2-ylimidazole?
The molecular weight of 1-But-3-en-2-ylimidazole is 122.08 g/mol.
Where can I buy 1-But-3-en-2-ylimidazole?
You can request a quote for 1-But-3-en-2-ylimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-But-3-en-2-ylimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-But-3-en-2-ylimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.