O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate
TL;DR: O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate (CAS 138111-23-6) is a chemical compound with molecular formula C5H9NO2S2 and molecular weight 179.00748 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate
Also Known As: O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate, Carbonodithioic acid, S-(2-amino-2-oxoethyl) O-ethyl ester
Technical Specifications
| Molecular Formula | C5H9NO2S2 |
| Molecular Weight | 179.00748 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 179.00748 Da |
| Heavy Atoms | 10 |
| Complexity | 138.0 |
| SMILES | CCOC(=S)SCC(=O)N |
| InChIKey | IWSQTMQUSQISET-UHFFFAOYSA-N |
Chemical Property Profile of O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate
Property Insights of O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate. Following Lipinski's Rule of Five, O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate 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
What is the CAS number of O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate?
The CAS number of O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate is 138111-23-6.
What is the molecular formula of O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate?
The molecular formula of O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate is C5H9NO2S2.
What is the molecular weight of O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate?
The molecular weight of O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate is 179.00748 g/mol.
Where can I buy O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate?
You can request a quote for O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate?
Yes, CoreyChem provides custom synthesis services for O-ethyl (2-amino-2-oxoethyl)sulfanylmethanethioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.