(3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid
TL;DR: (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid (CAS 1049975-91-8) is a chemical compound with molecular formula C11H12FNO2 and molecular weight 209.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid
Also Known As: (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid, 3-benzenesulfonylaminoaniline, Trans-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid, rac-(3R,4S)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid, 975F918
| Molecular Formula | C11H12FNO2 |
|---|---|
| Molecular Weight | 209.09 g/mol |
| LogP | 1.2133 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.0852 |
| Heavy Atoms | 15 |
| Complexity | 380.6056 |
Chemical Identifiers
| CAS Number | 1049975-91-8 |
|---|---|
| SMILES | C1[C@H]([C@@H](CN1)C(=O)O)C2=CC=CC=C2F |
Product Overview
(3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid (CAS 1049975-91-8), with molecular formula C11H12FNO2 and molecular weight 209.09 g/mol. IUPAC: (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid.
Chemical Property Profile of (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid
Property Insights of (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid
The XLogP value of 1.2133 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid. With a topological polar surface area (TPSA) of 49.33 Ų, (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid?
The CAS number of (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid is 1049975-91-8.
What is the molecular formula of (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid?
The molecular formula of (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid is C11H12FNO2.
What is the molecular weight of (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid?
The molecular weight of (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid is 209.09 g/mol.
Where can I buy (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid?
You can request a quote for (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.