2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one
TL;DR: 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one (CAS 121514-30-5) is a chemical compound with molecular formula C12H20N2O and molecular weight 208.15756 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-tert-butyl-1-imidazol-1-ylpentan-1-one
Also Known As: 2-tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one, 2-tert-butyl-1-imidazol-1-ylpentan-1-one, 1-imidazol-1-yl-2-tert-butyl-pentan-1-one, 2-(tert-Butyl)-1-(1H-imidazol-1-yl)pentan-1-one, 1-Pentanone,2-(1,1-dimethylethyl)-1-(1H-imidazol-1-yl)-
Technical Specifications
| Molecular Formula | C12H20N2O |
| Molecular Weight | 208.15756 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.15756 Da |
| Heavy Atoms | 15 |
| Complexity | 220.0 |
| SMILES | CCCC(C(=O)N1C=CN=C1)C(C)(C)C |
| InChIKey | FSHJTAKRYIGTGX-UHFFFAOYSA-N |
Chemical Property Profile of 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one
Property Insights of 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one
The XLogP value of 3.0 indicates that 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.9 Ų, 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one?
The CAS number of 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one is 121514-30-5.
What is the molecular formula of 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one?
The molecular formula of 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one is C12H20N2O.
What is the molecular weight of 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one?
The molecular weight of 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one is 208.15756 g/mol.
Where can I buy 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one?
You can request a quote for 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one?
Yes, CoreyChem provides custom synthesis services for 2-Tert-butyl-1-(1h-imidazol-1-yl)pentan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.