TL;DR: 1-Acetoxy-1-(3-methylphenyl)-2-(2-(morpholin-4-yl)ethoxy)ethane (CAS 131962-90-8) is a chemical compound with molecular formula C17H25NO4 and molecular weight 307.17834 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-(3-methylphenyl)-2-(2-morpholin-4-ylethoxy)ethyl] acetate
Also Known As: 1-Acetoxy-1-(3-methylphenyl)-2-(2-(morpholin-4-yl)ethoxy)ethane, 3-Methyl-alpha-((2-(4-morpholinyl)ethoxy)methyl)benzenemethanol acetate (ester), Benzenemethanol, 3-methyl-alpha-((2-(4-morpholinyl)ethoxy)methyl)-, acetate (ester), [1-(3-methylphenyl)-2-(2-morpholin-4-ylethoxy)ethyl] acetate, 1-acetoxy-1-(3-methylphenyl)-2-[2-(morpholin-4-yl)ethoxy]ethane
| Molecular Formula | C17H25NO4 |
| Molecular Weight | 307.17834 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 307.17834 Da |
| Heavy Atoms | 22 |
| Complexity | 331.0 |
| SMILES | CC1=CC(=CC=C1)C(COCCN2CCOCC2)OC(=O)C |
| InChIKey | JAIOLZALHYEOJT-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Acetoxy-1-(3-methylphenyl)-2-(2-(morpholin-4-yl)ethoxy)ethane. With a topological polar surface area (TPSA) of 48.0 Ų, 1-Acetoxy-1-(3-methylphenyl)-2-(2-(morpholin-4-yl)ethoxy)ethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Acetoxy-1-(3-methylphenyl)-2-(2-(morpholin-4-yl)ethoxy)ethane has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Acetoxy-1-(3-methylphenyl)-2-(2-(morpholin-4-yl)ethoxy)ethane is 131962-90-8.
The molecular formula of 1-Acetoxy-1-(3-methylphenyl)-2-(2-(morpholin-4-yl)ethoxy)ethane is C17H25NO4.
The molecular weight of 1-Acetoxy-1-(3-methylphenyl)-2-(2-(morpholin-4-yl)ethoxy)ethane is 307.17834 g/mol.
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