Ethanethiol, 2-imino-, diacetate
TL;DR: Ethanethiol, 2-imino-, diacetate (CAS 101221-41-4) is a chemical compound with molecular formula C6H13NO4S and molecular weight 195.05653 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
acetic acid;2-iminoethanethiol
Also Known As: Meida, Maeida, Maeida [German], 2-Iminoethanethiol diacetate, 2-Mercaptoaethyliminodiacetat
Technical Specifications
| Molecular Formula | C6H13NO4S |
| Molecular Weight | 195.05653 g/mol |
| XLogP | 0.74757 |
| Topological Polar Surface Area (TPSA) | 99.5 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.05653 Da |
| Heavy Atoms | 12 |
| Complexity | 51.0 |
| SMILES | CC(=O)O.CC(=O)O.C(C=N)S |
| InChIKey | HVYLDJKDVOOTHV-UHFFFAOYSA-N |
Chemical Property Profile of Ethanethiol, 2-imino-, diacetate
Property Insights of Ethanethiol, 2-imino-, diacetate
The XLogP value of 0.74757 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanethiol, 2-imino-, diacetate. The TPSA of 99.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanethiol, 2-imino-, diacetate. Following Lipinski's Rule of Five, Ethanethiol, 2-imino-, diacetate has 4 hydrogen bond donor(s) and 6 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-imino-, diacetate?
The CAS number of Ethanethiol, 2-imino-, diacetate is 101221-41-4.
What is the molecular formula of Ethanethiol, 2-imino-, diacetate?
The molecular formula of Ethanethiol, 2-imino-, diacetate is C6H13NO4S.
What is the molecular weight of Ethanethiol, 2-imino-, diacetate?
The molecular weight of Ethanethiol, 2-imino-, diacetate is 195.05653 g/mol.
Where can I buy Ethanethiol, 2-imino-, diacetate?
You can request a quote for Ethanethiol, 2-imino-, diacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethanethiol, 2-imino-, diacetate?
Yes, CoreyChem provides custom synthesis services for Ethanethiol, 2-imino-, diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.