Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate
TL;DR: Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate (CAS 120806-96-4) is a chemical compound with molecular formula C13H15NO4 and molecular weight 249.10011 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate
Also Known As: Diethylsilane, (2S,4R)-Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate, Trans-1-benzoyl-4-hydroxy-L-prolinemethyl Ester, METHYLN-BENZOYL-4-HYDROXYPROLINATE, methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate
Technical Specifications
| Molecular Formula | C13H15NO4 |
| Molecular Weight | 249.10011 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.10011 Da |
| Heavy Atoms | 18 |
| Complexity | 325.0 |
| SMILES | COC(=O)C1CC(CN1C(=O)C2=CC=CC=C2)O |
| InChIKey | QEQGWOLBDNOSAD-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate
Property Insights of Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate. Following Lipinski's Rule of Five, Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate has 1 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 Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate?
The CAS number of Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate is 120806-96-4.
What is the molecular formula of Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate?
The molecular formula of Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate is C13H15NO4.
What is the molecular weight of Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate?
The molecular weight of Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate is 249.10011 g/mol.
Where can I buy Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate?
You can request a quote for Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 1-benzoyl-4-hydroxypyrrolidine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.