2-Pyridin-2-ylethynethiol
TL;DR: 2-Pyridin-2-ylethynethiol (CAS 1024284-20-5) is a chemical compound with molecular formula C7H5NS and molecular weight 135.01427 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-pyridin-2-ylethynethiol
Also Known As: 2-pyridin-2-ylethynethiol, (Pyridin-2-yl)ethyne-1-thiol, Ethynethiol, 2-(2-pyridinyl)-, 2-(2-PYRIDINYL)-ETHYNETHIOL
Technical Specifications
| Molecular Formula | C7H5NS |
| Molecular Weight | 135.01427 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 13.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 135.01427 Da |
| Heavy Atoms | 9 |
| Complexity | 141.0 |
| SMILES | C1=CC=NC(=C1)C#CS |
| InChIKey | ZNDNCTAYOSAEQC-UHFFFAOYSA-N |
Chemical Property Profile of 2-Pyridin-2-ylethynethiol
Property Insights of 2-Pyridin-2-ylethynethiol
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyridin-2-ylethynethiol. With a topological polar surface area (TPSA) of 13.9 Ų, 2-Pyridin-2-ylethynethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyridin-2-ylethynethiol 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 2-Pyridin-2-ylethynethiol?
The CAS number of 2-Pyridin-2-ylethynethiol is 1024284-20-5.
What is the molecular formula of 2-Pyridin-2-ylethynethiol?
The molecular formula of 2-Pyridin-2-ylethynethiol is C7H5NS.
What is the molecular weight of 2-Pyridin-2-ylethynethiol?
The molecular weight of 2-Pyridin-2-ylethynethiol is 135.01427 g/mol.
Where can I buy 2-Pyridin-2-ylethynethiol?
You can request a quote for 2-Pyridin-2-ylethynethiol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Pyridin-2-ylethynethiol?
Yes, CoreyChem provides custom synthesis services for 2-Pyridin-2-ylethynethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.