Ethanethiol, 2-(diallylamino)-
TL;DR: Ethanethiol, 2-(diallylamino)- (CAS 5842-11-5) is a chemical compound with molecular formula C8H15NS and molecular weight 157.09251 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[bis(prop-2-enyl)amino]ethanethiol
Also Known As: 2-(diallylamino)ethanethiol, N-Diallylcysteamin, N-Diallylcysteamin [German], Ethanethiol, 2-(diallylamino)-, 2-(diallylamino) ethanethiol
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H15NS |
| Molecular Weight | 157.09251 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 4.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 157.09251 Da |
| Heavy Atoms | 10 |
| Complexity | 91.0 |
| SMILES | C=CCN(CCS)CC=C |
| InChIKey | MUNCUGLIPQTLKH-UHFFFAOYSA-N |
Chemical Property Profile of Ethanethiol, 2-(diallylamino)-
Property Insights of Ethanethiol, 2-(diallylamino)-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanethiol, 2-(diallylamino)-. With a topological polar surface area (TPSA) of 4.2 Ų, Ethanethiol, 2-(diallylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanethiol, 2-(diallylamino)- has 1 hydrogen bond donor(s) and 2 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-(diallylamino)-?
The CAS number of Ethanethiol, 2-(diallylamino)- is 5842-11-5.
What is the molecular formula of Ethanethiol, 2-(diallylamino)-?
The molecular formula of Ethanethiol, 2-(diallylamino)- is C8H15NS.
What is the molecular weight of Ethanethiol, 2-(diallylamino)-?
The molecular weight of Ethanethiol, 2-(diallylamino)- is 157.09251 g/mol.
Where can I buy Ethanethiol, 2-(diallylamino)-?
You can request a quote for Ethanethiol, 2-(diallylamino)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethanethiol, 2-(diallylamino)-?
Yes, CoreyChem provides custom synthesis services for Ethanethiol, 2-(diallylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.