2-Butyl-2-imidazoline
TL;DR: 2-Butyl-2-imidazoline (CAS 10443-59-1) is a chemical compound with molecular formula C7H14N2 and molecular weight 126.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-4,5-dihydro-1H-imidazole
Also Known As: 2-Butyl-2-imidazoline, 2-n-Butyl-imidazolin, 2-IMIDAZOLINE, 2-BUTYL-, 2-butyl-4,5-dihydro-1H-imidazole, 1H-Imidazole, 2-butyl-4,5-dihydro-
| Molecular Formula | C7H14N2 |
|---|---|
| Molecular Weight | 126.12 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 126.1157 |
| Heavy Atoms | 9 |
| Complexity | 107.0 |
Chemical Identifiers
| CAS Number | 10443-59-1 |
|---|---|
| SMILES | CCCCC1=NCCN1 |
| InChIKey | XTRFSGCFRISMDG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Butyl-2-imidazoline (CAS 10443-59-1), with molecular formula C7H14N2 and molecular weight 126.12 g/mol. IUPAC: 2-butyl-4,5-dihydro-1H-imidazole.
Chemical Property Profile of 2-Butyl-2-imidazoline
Property Insights of 2-Butyl-2-imidazoline
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butyl-2-imidazoline. With a topological polar surface area (TPSA) of 24.4 Ų, 2-Butyl-2-imidazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butyl-2-imidazoline has 1 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 2-Butyl-2-imidazoline?
The CAS number of 2-Butyl-2-imidazoline is 10443-59-1.
What is the molecular formula of 2-Butyl-2-imidazoline?
The molecular formula of 2-Butyl-2-imidazoline is C7H14N2.
What is the molecular weight of 2-Butyl-2-imidazoline?
The molecular weight of 2-Butyl-2-imidazoline is 126.12 g/mol.
Where can I buy 2-Butyl-2-imidazoline?
You can request a quote for 2-Butyl-2-imidazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butyl-2-imidazoline?
Yes, KEHONG BIO provides custom synthesis services for 2-Butyl-2-imidazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.