TL;DR: 4-ethoxy-5-hexyl-5-methyl-4H-oxazole (CAS 128101-14-4) is a chemical compound with molecular formula C12H23NO2 and molecular weight 213.17288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-ethoxy-5-hexyl-5-methyl-4H-1,3-oxazole
Also Known As: 4-ethoxy-5-hexyl-5-methyl-4H-oxazole, 4-ethoxy-5-hexyl-5-methyl-4H-1,3-oxazole, 4-ethoxy-5-hexyl-5-methyl-4,5-dihydro-1,3-oxazole, OXAZOLE, 4-ETHOXY-5-HEXYL-4,5-DIHYDRO-5-METHYL-, Oxazole, 4-ethoxy-5-hexyl-4,5-dihydro-5-methyl- (9CI)
| Molecular Formula | C12H23NO2 |
| Molecular Weight | 213.17288 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 30.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 213.17288 Da |
| Heavy Atoms | 15 |
| Complexity | 206.0 |
| SMILES | CCCCCCC1(C(N=CO1)OCC)C |
| InChIKey | KRNPNNQLUJXHLA-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that 4-ethoxy-5-hexyl-5-methyl-4H-oxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.8 Ų, 4-ethoxy-5-hexyl-5-methyl-4H-oxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-ethoxy-5-hexyl-5-methyl-4H-oxazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-ethoxy-5-hexyl-5-methyl-4H-oxazole is 128101-14-4.
The molecular formula of 4-ethoxy-5-hexyl-5-methyl-4H-oxazole is C12H23NO2.
The molecular weight of 4-ethoxy-5-hexyl-5-methyl-4H-oxazole is 213.17288 g/mol.
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