(3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid
TL;DR: (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid (CAS 1049978-45-1) is a chemical compound with molecular formula C11H11Cl2NO2 and molecular weight 259.0167 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid
Also Known As: (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid, 978D451, 3-Pyrrolidinecarboxylicacid, 4-(2,5-dichlorophenyl)-, (3S,4R)-, (3R,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic Acid, (3S,4R)-4-(2,5-Dichlorophenyl)pyrrolidine-3-carboxylicacid
Technical Specifications
| Molecular Formula | C11H11Cl2NO2 |
| Molecular Weight | 259.0167 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.0167 Da |
| Heavy Atoms | 16 |
| Complexity | 275.0 |
| SMILES | C1[C@H]([C@@H](CN1)C(=O)O)C2=C(C=CC(=C2)Cl)Cl |
| InChIKey | VKDXYQPZUWSCKU-DTWKUNHWSA-N |
Chemical Property Profile of (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid
Property Insights of (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid
The XLogP value of -0.2 indicates that (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.3 Ų, (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid?
The CAS number of (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid is 1049978-45-1.
What is the molecular formula of (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid?
The molecular formula of (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid is C11H11Cl2NO2.
What is the molecular weight of (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid?
The molecular weight of (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid is 259.0167 g/mol.
Where can I buy (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid?
You can request a quote for (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for (3S,4R)-4-(2,5-dichlorophenyl)pyrrolidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.