3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid
TL;DR: 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid (CAS 6116-84-3) is a chemical compound with molecular formula C11H9NO4 and molecular weight 219.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,5-dioxopyrrolidin-1-yl)benzoic acid
Also Known As: 3-(2,5-dioxopyrrolidin-1-yl)benzoic acid, L-threonine, 3-(2,5-Dioxo-pyrrolidin-1-yl)-benzoic acid, 3-succinimidobenzoic acid, 3- -BENZOICACID
| Molecular Formula | C11H9NO4 |
|---|---|
| Molecular Weight | 219.05 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.05316 |
| Heavy Atoms | 16 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 6116-84-3 |
|---|---|
| SMILES | C1CC(=O)N(C1=O)C2=CC=CC(=C2)C(=O)O |
| InChIKey | BEQRYKGDEGNALQ-UHFFFAOYSA-N |
Product Overview
3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid (CAS 6116-84-3), with molecular formula C11H9NO4 and molecular weight 219.05 g/mol. IUPAC: 3-(2,5-dioxopyrrolidin-1-yl)benzoic acid.
Chemical Property Profile of 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid
Property Insights of 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid
The XLogP value of -0.1 indicates that 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid. Following Lipinski's Rule of Five, 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid has 1 hydrogen bond donor(s) and 4 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-(2,5-Dioxopyrrolidin-1-yl)benzoic acid?
The CAS number of 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid is 6116-84-3.
What is the molecular formula of 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid?
The molecular formula of 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid is C11H9NO4.
What is the molecular weight of 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid?
The molecular weight of 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid is 219.05 g/mol.
Where can I buy 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid?
You can request a quote for 3-(2,5-Dioxopyrrolidin-1-yl)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-(2,5-Dioxopyrrolidin-1-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.