(3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid
TL;DR: (3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid (CAS 1047651-79-5) is a chemical compound with molecular formula C11H12ClNO2 and molecular weight 225.05565 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid
Also Known As: (3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid, Trans-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid, 3-Pyrrolidinecarboxylicacid, 4-(2-chlorophenyl)-, (3S,4R)-, B-1871, 651C795
Technical Specifications
| Molecular Formula | C11H12ClNO2 |
| Molecular Weight | 225.05565 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.05565 Da |
| Heavy Atoms | 15 |
| Complexity | 247.0 |
| SMILES | C1[C@H]([C@@H](CN1)C(=O)O)C2=CC=CC=C2Cl |
| InChIKey | JGQMSOHBYCXLNS-DTWKUNHWSA-N |
Chemical Property Profile of (3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid
Property Insights of (3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid
The XLogP value of -0.8 indicates that (3S,4R)-4-(2-chlorophenyl)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-chlorophenyl)pyrrolidine-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S,4R)-4-(2-chlorophenyl)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-chlorophenyl)pyrrolidine-3-carboxylic acid?
The CAS number of (3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid is 1047651-79-5.
What is the molecular formula of (3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid?
The molecular formula of (3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid is C11H12ClNO2.
What is the molecular weight of (3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid?
The molecular weight of (3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid is 225.05565 g/mol.
Where can I buy (3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid?
You can request a quote for (3S,4R)-4-(2-chlorophenyl)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-chlorophenyl)pyrrolidine-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for (3S,4R)-4-(2-chlorophenyl)pyrrolidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.