1-Butyl-2-hydroxymethylimidazole
TL;DR: 1-Butyl-2-hydroxymethylimidazole (CAS 150693-45-1) is a chemical compound with molecular formula C8H14N2O and molecular weight 154.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-butylimidazol-2-yl)methanol
Also Known As: 1-Butyl-2-hydroxymethylimidazole, (1-butylimidazol-2-yl)methanol, (1-Butyl-1H-imidazol-2-yl)methanol, 1-Butyl-1H-imidazole-2-methanol, 1H-Imidazole-2-methanol, 1-butyl-
| Molecular Formula | C8H14N2O |
|---|---|
| Molecular Weight | 154.11 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 154.11061 |
| Heavy Atoms | 11 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 150693-45-1 |
|---|---|
| SMILES | CCCCN1C=CN=C1CO |
| InChIKey | AOPMHPFNYCNHJU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Butyl-2-hydroxymethylimidazole (CAS 150693-45-1), with molecular formula C8H14N2O and molecular weight 154.11 g/mol. IUPAC: (1-butylimidazol-2-yl)methanol.
Chemical Property Profile of 1-Butyl-2-hydroxymethylimidazole
Property Insights of 1-Butyl-2-hydroxymethylimidazole
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butyl-2-hydroxymethylimidazole. With a topological polar surface area (TPSA) of 38.1 Ų, 1-Butyl-2-hydroxymethylimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butyl-2-hydroxymethylimidazole has 1 hydrogen bond donor(s) and 2 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-Butyl-2-hydroxymethylimidazole?
The CAS number of 1-Butyl-2-hydroxymethylimidazole is 150693-45-1.
What is the molecular formula of 1-Butyl-2-hydroxymethylimidazole?
The molecular formula of 1-Butyl-2-hydroxymethylimidazole is C8H14N2O.
What is the molecular weight of 1-Butyl-2-hydroxymethylimidazole?
The molecular weight of 1-Butyl-2-hydroxymethylimidazole is 154.11 g/mol.
Where can I buy 1-Butyl-2-hydroxymethylimidazole?
You can request a quote for 1-Butyl-2-hydroxymethylimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butyl-2-hydroxymethylimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Butyl-2-hydroxymethylimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.