5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid
TL;DR: 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid (CAS 1217542-54-5) is a chemical compound with molecular formula C13H11NO5 and molecular weight 261.06372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-oxo-1-(3-oxo-1H-2-benzofuran-1-yl)pyrrolidine-2-carboxylic acid
Also Known As: EiM17-03082, 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid, 5-oxo-1-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)-D-proline, 5-oxo-1-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)pyrrolidine-2-carboxylic acid, 5-oxo-1-(3-oxo-1H-2-benzofuran-1-yl)pyrrolidine-2-carboxylic acid
Technical Specifications
| Molecular Formula | C13H11NO5 |
| Molecular Weight | 261.06372 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 83.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.06372 Da |
| Heavy Atoms | 19 |
| Complexity | 435.0 |
| SMILES | C1CC(=O)N(C1C(=O)O)C2C3=CC=CC=C3C(=O)O2 |
| InChIKey | BBYDVCBRFNLCJZ-UHFFFAOYSA-N |
Chemical Property Profile of 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid
Property Insights of 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid. Following Lipinski's Rule of Five, 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid?
The CAS number of 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid is 1217542-54-5.
What is the molecular formula of 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid?
The molecular formula of 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid is C13H11NO5.
What is the molecular weight of 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid?
The molecular weight of 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid is 261.06372 g/mol.
Where can I buy 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid?
You can request a quote for 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid?
Yes, CoreyChem provides custom synthesis services for 5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.