Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate
TL;DR: Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate (CAS 16257-57-1) is a chemical compound with molecular formula C13H17NO5S and molecular weight 299.08273 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-hydroxy-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate
Also Known As: Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate, Methyl 4-hydroxy-1-[(4-methylphenyl)sulfonyl]-2-pyrrolidinecarboxylate, 1,3-Bis(isocyanatomethyl)cyclohexane, 8247AA, methyl 4-hydroxy-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate
Technical Specifications
| Molecular Formula | C13H17NO5S |
| Molecular Weight | 299.08273 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 92.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.08273 Da |
| Heavy Atoms | 20 |
| Complexity | 450.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)OC)O |
| InChIKey | XUMMBVXGIOJOPC-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate
Property Insights of Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate. Following Lipinski's Rule of Five, Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate has 1 hydrogen bond donor(s) and 6 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 4-hydroxy-1-tosylpyrrolidine-2-carboxylate?
The CAS number of Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate is 16257-57-1.
What is the molecular formula of Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate?
The molecular formula of Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate is C13H17NO5S.
What is the molecular weight of Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate?
The molecular weight of Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate is 299.08273 g/mol.
Where can I buy Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate?
You can request a quote for Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-hydroxy-1-tosylpyrrolidine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.