(2R,4S)-pyrrolidine-2,4-dicarboxylic acid
TL;DR: (2R,4S)-pyrrolidine-2,4-dicarboxylic acid (CAS 159000-54-1) is a chemical compound with molecular formula C6H9NO4 and molecular weight 159.05316 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,4S)-pyrrolidine-2,4-dicarboxylic acid
Also Known As: Thiohexam, (2R,4S)-pyrrolidine-2,4-dicarboxylic acid, trans-4-Carboxy-L-proline, L-trans-Pyrrolidine-2,4-dicarboxylic acid, trans-pyrrolidine-2,4-dicarboxylic acid
Technical Specifications
| Molecular Formula | C6H9NO4 |
| Molecular Weight | 159.05316 g/mol |
| XLogP | -3.2 |
| Topological Polar Surface Area (TPSA) | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 159.05316 Da |
| Heavy Atoms | 11 |
| Complexity | 191.0 |
| SMILES | C1[C@@H](CN[C@H]1C(=O)O)C(=O)O |
| InChIKey | NRSBQSJHFYZIPH-IUYQGCFVSA-N |
Chemical Property Profile of (2R,4S)-pyrrolidine-2,4-dicarboxylic acid
Property Insights of (2R,4S)-pyrrolidine-2,4-dicarboxylic acid
The XLogP value of -3.2 indicates that (2R,4S)-pyrrolidine-2,4-dicarboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (2R,4S)-pyrrolidine-2,4-dicarboxylic acid. Following Lipinski's Rule of Five, (2R,4S)-pyrrolidine-2,4-dicarboxylic acid has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2R,4S)-pyrrolidine-2,4-dicarboxylic acid?
The CAS number of (2R,4S)-pyrrolidine-2,4-dicarboxylic acid is 159000-54-1.
What is the molecular formula of (2R,4S)-pyrrolidine-2,4-dicarboxylic acid?
The molecular formula of (2R,4S)-pyrrolidine-2,4-dicarboxylic acid is C6H9NO4.
What is the molecular weight of (2R,4S)-pyrrolidine-2,4-dicarboxylic acid?
The molecular weight of (2R,4S)-pyrrolidine-2,4-dicarboxylic acid is 159.05316 g/mol.
Where can I buy (2R,4S)-pyrrolidine-2,4-dicarboxylic acid?
You can request a quote for (2R,4S)-pyrrolidine-2,4-dicarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2R,4S)-pyrrolidine-2,4-dicarboxylic acid?
Yes, CoreyChem provides custom synthesis services for (2R,4S)-pyrrolidine-2,4-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.