Pyridine-2-thioacetonitrile
TL;DR: Pyridine-2-thioacetonitrile (CAS 7521-19-9) is a chemical compound with molecular formula C7H6N2S and molecular weight 150.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyridin-2-ylsulfanylacetonitrile
Also Known As: Pyridine-2-thioacetonitrile, cyanomethylthioazine, 2-pyridin-2-ylsulfanylacetonitrile, (2-Pyridinylthio)acetonitrile, 2-(pyridin-2-ylthio)acetonitrile
| Molecular Formula | C7H6N2S |
|---|---|
| Molecular Weight | 150.03 g/mol |
| LogP | 1.69728 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 150.02516 |
| Heavy Atoms | 10 |
| Complexity | 227.11147 |
Chemical Identifiers
| CAS Number | 7521-19-9 |
|---|---|
| SMILES | C1=CC=NC(=C1)SCC#N |
Product Overview
Pyridine-2-thioacetonitrile (CAS 7521-19-9), with molecular formula C7H6N2S and molecular weight 150.03 g/mol. IUPAC: 2-pyridin-2-ylsulfanylacetonitrile.
Chemical Property Profile of Pyridine-2-thioacetonitrile
Property Insights of Pyridine-2-thioacetonitrile
The XLogP value of 1.69728 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridine-2-thioacetonitrile. With a topological polar surface area (TPSA) of 36.68 Ų, Pyridine-2-thioacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridine-2-thioacetonitrile has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyridine-2-thioacetonitrile?
The CAS number of Pyridine-2-thioacetonitrile is 7521-19-9.
What is the molecular formula of Pyridine-2-thioacetonitrile?
The molecular formula of Pyridine-2-thioacetonitrile is C7H6N2S.
What is the molecular weight of Pyridine-2-thioacetonitrile?
The molecular weight of Pyridine-2-thioacetonitrile is 150.03 g/mol.
Where can I buy Pyridine-2-thioacetonitrile?
You can request a quote for Pyridine-2-thioacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridine-2-thioacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for Pyridine-2-thioacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.