(2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester
TL;DR: (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester (CAS 144688-81-3) is a chemical compound with molecular formula C16H23NO2 and molecular weight 261.17288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl 2-benzylpyrrolidine-1-carboxylate
Also Known As: Tert-butyl 2-benzylpyrrolidine-1-carboxylate, J1.583.736E, 2-Benzylpyrrolidine-1-carboxylic acid tert-butyl ester, (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester
Technical Specifications
| Molecular Formula | C16H23NO2 |
| Molecular Weight | 261.17288 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.17288 Da |
| Heavy Atoms | 19 |
| Complexity | 302.0 |
| SMILES | CC(C)(C)OC(=O)N1CCCC1CC2=CC=CC=C2 |
| InChIKey | JZGHZJDPCJDSTP-UHFFFAOYSA-N |
Chemical Property Profile of (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester
Property Insights of (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester
The XLogP value of 3.6 indicates that (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester?
The CAS number of (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester is 144688-81-3.
What is the molecular formula of (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester?
The molecular formula of (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester is C16H23NO2.
What is the molecular weight of (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester?
The molecular weight of (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester is 261.17288 g/mol.
Where can I buy (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester?
You can request a quote for (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester?
Yes, CoreyChem provides custom synthesis services for (2RS)-2-benzyl-pyrrolidine-1-carboxylic acid tert-butyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.