![3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid structure](/static/products/916/91634-12-7.png)
3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid
TL;DR: 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid (CAS 91634-12-7) is a chemical compound with molecular formula C13H15NO4 and molecular weight 249.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(2-oxopyrrolidin-1-yl)ethoxy]benzoic acid
Also Known As: 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid, 3-[2-(2-oxopyrrolidin-1-yl)ethoxy]benzoic acid, 3-(2-(2-Oxopyrrolidin-1-yl)ethoxy)benzoic acid, 2-VINYL-4-QUINAZOLINOL, ASN 14098326
| Molecular Formula | C13H15NO4 |
|---|---|
| Molecular Weight | 249.10 g/mol |
| LogP | 1.386 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.10011 |
| Heavy Atoms | 18 |
| Complexity | 458.0594 |
Chemical Identifiers
| CAS Number | 91634-12-7 |
|---|---|
| SMILES | C1CC(=O)N(C1)CCOC2=CC=CC(=C2)C(=O)O |
Product Overview
3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid (CAS 91634-12-7), with molecular formula C13H15NO4 and molecular weight 249.10 g/mol. IUPAC: 3-[2-(2-oxopyrrolidin-1-yl)ethoxy]benzoic acid.
Chemical Property Profile of 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid
Property Insights of 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid
The XLogP value of 1.386 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid. Following Lipinski's Rule of Five, 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid has 1 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 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid?
The CAS number of 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid is 91634-12-7.
What is the molecular formula of 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid?
The molecular formula of 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid is C13H15NO4.
What is the molecular weight of 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid?
The molecular weight of 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid is 249.10 g/mol.
Where can I buy 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid?
You can request a quote for 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(2-Oxo-pyrrolidin-1-yl)-ethoxy]-benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.