Ethanethiol, 2-(acetoacetylamino)-
TL;DR: Ethanethiol, 2-(acetoacetylamino)- (CAS 63950-93-6) is a chemical compound with molecular formula C6H11NO2S and molecular weight 161.05106 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-oxo-N-(2-sulfanylethyl)butanamide
Also Known As: 2- ethanethiol, acetoacetyl-cysteamine, N-Aceto acetyl cysteamin, Ethanethiol, 2-(acetoacetylamino)-, 2-(Acetoacetylamino)ethanethiol
Technical Specifications
| Molecular Formula | C6H11NO2S |
| Molecular Weight | 161.05106 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 47.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 161.05106 Da |
| Heavy Atoms | 10 |
| Complexity | 136.0 |
| SMILES | CC(=O)CC(=O)NCCS |
| InChIKey | HGFWQRPSTVETPL-UHFFFAOYSA-N |
Chemical Property Profile of Ethanethiol, 2-(acetoacetylamino)-
Property Insights of Ethanethiol, 2-(acetoacetylamino)-
The XLogP value of -0.3 indicates that Ethanethiol, 2-(acetoacetylamino)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 47.2 Ų, Ethanethiol, 2-(acetoacetylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanethiol, 2-(acetoacetylamino)- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethanethiol, 2-(acetoacetylamino)-?
The CAS number of Ethanethiol, 2-(acetoacetylamino)- is 63950-93-6.
What is the molecular formula of Ethanethiol, 2-(acetoacetylamino)-?
The molecular formula of Ethanethiol, 2-(acetoacetylamino)- is C6H11NO2S.
What is the molecular weight of Ethanethiol, 2-(acetoacetylamino)-?
The molecular weight of Ethanethiol, 2-(acetoacetylamino)- is 161.05106 g/mol.
Where can I buy Ethanethiol, 2-(acetoacetylamino)-?
You can request a quote for Ethanethiol, 2-(acetoacetylamino)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethanethiol, 2-(acetoacetylamino)-?
Yes, CoreyChem provides custom synthesis services for Ethanethiol, 2-(acetoacetylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.