DL-1-Acetyl-5-oxoproline
TL;DR: DL-1-Acetyl-5-oxoproline (CAS 53971-11-2) is a chemical compound with molecular formula C7H9NO4 and molecular weight 171.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-acetyl-5-oxopyrrolidine-2-carboxylic acid
Also Known As: DL-1-Acetyl-5-oxoproline, 1-acetyl-5-oxoproline, L-1-Acetyl-5-oxoproline, 1-acetyl-5-oxopyrrolidine-2-carboxylic acid, L-Proline, 1-acetyl-5-oxo-
| Molecular Formula | C7H9NO4 |
|---|---|
| Molecular Weight | 171.05 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 171.05316 |
| Heavy Atoms | 12 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 53971-11-2 |
|---|---|
| SMILES | CC(=O)N1C(CCC1=O)C(=O)O |
| InChIKey | AYNBBSMJRSAAHP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
DL-1-Acetyl-5-oxoproline (CAS 53971-11-2), with molecular formula C7H9NO4 and molecular weight 171.05 g/mol. IUPAC: 1-acetyl-5-oxopyrrolidine-2-carboxylic acid.
Chemical Property Profile of DL-1-Acetyl-5-oxoproline
Property Insights of DL-1-Acetyl-5-oxoproline
The XLogP value of -0.8 indicates that DL-1-Acetyl-5-oxoproline 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 DL-1-Acetyl-5-oxoproline. Following Lipinski's Rule of Five, DL-1-Acetyl-5-oxoproline 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 DL-1-Acetyl-5-oxoproline?
The CAS number of DL-1-Acetyl-5-oxoproline is 53971-11-2.
What is the molecular formula of DL-1-Acetyl-5-oxoproline?
The molecular formula of DL-1-Acetyl-5-oxoproline is C7H9NO4.
What is the molecular weight of DL-1-Acetyl-5-oxoproline?
The molecular weight of DL-1-Acetyl-5-oxoproline is 171.05 g/mol.
Where can I buy DL-1-Acetyl-5-oxoproline?
You can request a quote for DL-1-Acetyl-5-oxoproline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DL-1-Acetyl-5-oxoproline?
Yes, KEHONG BIO provides custom synthesis services for DL-1-Acetyl-5-oxoproline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.