Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester)
TL;DR: Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester) (CAS 25350-44-1) is a chemical compound with molecular formula C12H27NO3S2 and molecular weight 297.14325 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,7-dimethyl-1-(2-sulfosulfanylethylamino)octane
Also Known As: WR 3358, 3,7-dimethyl-1-(2-sulfosulfanylethylamino)octane, Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester), 2-((3,7-Dimethyloctyl)amino)ethanethiol hydrogen sulfate (ester), s-{2-[(3,7-dimethyloctyl)amino]ethyl} hydrogen sulfurothioate
Technical Specifications
| Molecular Formula | C12H27NO3S2 |
| Molecular Weight | 297.14325 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 297.14325 Da |
| Heavy Atoms | 18 |
| Complexity | 286.0 |
| SMILES | CC(C)CCCC(C)CCNCCSS(=O)(=O)O |
| InChIKey | JCONBDKVSVCZHB-UHFFFAOYSA-N |
Chemical Property Profile of Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester)
Property Insights of Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester)
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester). The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester). Following Lipinski's Rule of Five, Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester) has 2 hydrogen bond donor(s) and 5 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-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester)?
The CAS number of Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester) is 25350-44-1.
What is the molecular formula of Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester)?
The molecular formula of Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester) is C12H27NO3S2.
What is the molecular weight of Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester)?
The molecular weight of Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester) is 297.14325 g/mol.
Where can I buy Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester)?
You can request a quote for Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester)?
Yes, CoreyChem provides custom synthesis services for Ethanethiol, 2-((3,7-dimethyloctyl)amino)-, hydrogen sulfate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.