2-Morpholin-4-ylethyl 3,3-dimethylbutanoate
TL;DR: 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate (CAS 744149-21-1) is a chemical compound with molecular formula C12H23NO3 and molecular weight 229.1678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-morpholin-4-ylethyl 3,3-dimethylbutanoate
Also Known As: 2-morpholin-4-ylethyl 3,3-dimethylbutanoate, 2-(morpholin-4-yl)ethyl 3,3-dimethylbutanoate
Technical Specifications
| Molecular Formula | C12H23NO3 |
| Molecular Weight | 229.1678 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 229.1678 Da |
| Heavy Atoms | 16 |
| Complexity | 217.0 |
| SMILES | CC(C)(C)CC(=O)OCCN1CCOCC1 |
| InChIKey | NJSSRXJRYDPOKU-UHFFFAOYSA-N |
Chemical Property Profile of 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate
Property Insights of 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate. With a topological polar surface area (TPSA) of 38.8 Ų, 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate has 0 hydrogen bond donor(s) and 4 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-Morpholin-4-ylethyl 3,3-dimethylbutanoate?
The CAS number of 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate is 744149-21-1.
What is the molecular formula of 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate?
The molecular formula of 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate is C12H23NO3.
What is the molecular weight of 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate?
The molecular weight of 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate is 229.1678 g/mol.
Where can I buy 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate?
You can request a quote for 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate?
Yes, CoreyChem provides custom synthesis services for 2-Morpholin-4-ylethyl 3,3-dimethylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.