Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate
TL;DR: Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate (CAS 130317-10-1) is a chemical compound with molecular formula C16H21NO4 and molecular weight 291.14706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate
Also Known As: tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate, Tert-butyl 5-benzyl-2-oxo-morpholine-4-carboxylate
Technical Specifications
| Molecular Formula | C16H21NO4 |
| Molecular Weight | 291.14706 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.14706 Da |
| Heavy Atoms | 21 |
| Complexity | 382.0 |
| SMILES | CC(C)(C)OC(=O)N1CC(=O)OCC1CC2=CC=CC=C2 |
| InChIKey | NQZZZVQLJCFCGL-UHFFFAOYSA-N |
Chemical Property Profile of Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate
Property Insights of Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate. With a topological polar surface area (TPSA) of 55.8 Ų, Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate 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 Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate?
The CAS number of Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate is 130317-10-1.
What is the molecular formula of Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate?
The molecular formula of Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate is C16H21NO4.
What is the molecular weight of Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate?
The molecular weight of Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate is 291.14706 g/mol.
Where can I buy Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate?
You can request a quote for Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate?
Yes, CoreyChem provides custom synthesis services for Tert-butyl 5-benzyl-2-oxomorpholine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.