1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione
TL;DR: 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione (CAS 76045-62-0) is a chemical compound with molecular formula C11H11NO4 and molecular weight 221.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3,4-dihydroxypyrrolidine-2,5-dione
Also Known As: 1-benzyl-3,4-dihydroxypyrrolidine-2,5-dione, 2-Cyanopyridine, N-benzyl tartarimide, D-N-Benzyl tartarimide, 3,4-Dihydroxy-1-(phenylmethyl) 2,5-pyrrolidinedione
| Molecular Formula | C11H11NO4 |
|---|---|
| Molecular Weight | 221.07 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.0688 |
| Heavy Atoms | 16 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 76045-62-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)C(C(C2=O)O)O |
| InChIKey | IZBMPGFJNIDMRR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione (CAS 76045-62-0), with molecular formula C11H11NO4 and molecular weight 221.07 g/mol. IUPAC: 1-benzyl-3,4-dihydroxypyrrolidine-2,5-dione.
Chemical Property Profile of 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione
Property Insights of 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione
The XLogP value of -0.5 indicates that 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione. Following Lipinski's Rule of Five, 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione has 2 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 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione?
The CAS number of 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione is 76045-62-0.
What is the molecular formula of 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione?
The molecular formula of 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione is C11H11NO4.
What is the molecular weight of 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione?
The molecular weight of 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione is 221.07 g/mol.
Where can I buy 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione?
You can request a quote for 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3,4-dihydroxypyrrolidine-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.