5-oxothiomorpholine-3-carboxylic Acid
TL;DR: 5-oxothiomorpholine-3-carboxylic Acid (CAS 1184976-66-6) is a chemical compound with molecular formula C5H7NO3S and molecular weight 161.01466 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-oxothiomorpholine-3-carboxylic acid
Also Known As: 5-oxothiomorpholine-3-carboxylic Acid, 5-Oxo-thiomorpholine-3-carboxylic acid, Carbocysteine impurity A, 3-Thiomorpholinecarboxylic acid, 5-oxo-, Carbocisteine Impurity A
Technical Specifications
| Molecular Formula | C5H7NO3S |
| Molecular Weight | 161.01466 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 91.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.01466 Da |
| Heavy Atoms | 10 |
| Complexity | 170.0 |
| SMILES | C1C(NC(=O)CS1)C(=O)O |
| InChIKey | ZCITVSIKDJSWSS-UHFFFAOYSA-N |
Chemical Property Profile of 5-oxothiomorpholine-3-carboxylic Acid
Property Insights of 5-oxothiomorpholine-3-carboxylic Acid
The XLogP value of -0.4 indicates that 5-oxothiomorpholine-3-carboxylic Acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-oxothiomorpholine-3-carboxylic Acid. Following Lipinski's Rule of Five, 5-oxothiomorpholine-3-carboxylic Acid 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
What is the CAS number of 5-oxothiomorpholine-3-carboxylic Acid?
The CAS number of 5-oxothiomorpholine-3-carboxylic Acid is 1184976-66-6.
What is the molecular formula of 5-oxothiomorpholine-3-carboxylic Acid?
The molecular formula of 5-oxothiomorpholine-3-carboxylic Acid is C5H7NO3S.
What is the molecular weight of 5-oxothiomorpholine-3-carboxylic Acid?
The molecular weight of 5-oxothiomorpholine-3-carboxylic Acid is 161.01466 g/mol.
Where can I buy 5-oxothiomorpholine-3-carboxylic Acid?
You can request a quote for 5-oxothiomorpholine-3-carboxylic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-oxothiomorpholine-3-carboxylic Acid?
Yes, CoreyChem provides custom synthesis services for 5-oxothiomorpholine-3-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.