1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid
TL;DR: 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid (CAS 691906-49-7) is a chemical compound with molecular formula C14H19NO3 and molecular weight 249.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid
Also Known As: 1-BENZYL-4-(2-HYDROXY-ETHYL)-PYRROLIDINE-3-CARBOXYLIC ACID, 1-benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic Acid
| Molecular Formula | C14H19NO3 |
|---|---|
| Molecular Weight | 249.14 g/mol |
| LogP | 1.2016 |
| Topological Polar Surface Area | 60.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.13649 |
| Heavy Atoms | 18 |
| Complexity | 393.2854 |
Chemical Identifiers
| CAS Number | 691906-49-7 |
|---|---|
| SMILES | C1C(C(CN1CC2=CC=CC=C2)C(=O)O)CCO |
Product Overview
1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid (CAS 691906-49-7), with molecular formula C14H19NO3 and molecular weight 249.14 g/mol. IUPAC: 1-benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid.
Chemical Property Profile of 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid
Property Insights of 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid
The XLogP value of 1.2016 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid. The TPSA of 60.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid. Following Lipinski's Rule of Five, 1-Benzyl-4-(2-hydroxyethyl)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
Frequently Asked Questions
What is the CAS number of 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid?
The CAS number of 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid is 691906-49-7.
What is the molecular formula of 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid?
The molecular formula of 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid is C14H19NO3.
What is the molecular weight of 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid?
The molecular weight of 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid is 249.14 g/mol.
Where can I buy 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid?
You can request a quote for 1-Benzyl-4-(2-hydroxyethyl)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 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-4-(2-hydroxyethyl)pyrrolidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.