Pyridine-2-carbonitrile
TL;DR: Pyridine-2-carbonitrile (CAS 100-70-9) is a chemical compound with molecular formula C6H4N2 and molecular weight 104.037445 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pyridine-2-carbonitrile
Also Known As: 2-Cyanopyridine, Picolinonitrile, Pyridine-2-carbonitrile, 2-PYRIDINECARBONITRILE, Pyridinecarbonitrile
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H4N2 |
| Molecular Weight | 104.037445 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 36.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 104.037445 Da |
| Heavy Atoms | 8 |
| Complexity | 111.0 |
| Melting Point | 29 °C |
| Boiling Point | 224.5 °C |
| Density | 1.0810 @ 25 °C |
| Vapor Pressure | 0.09 [mmHg] |
| Refractive Index | Index of refraction: 1.5242 @ 25 °C/D |
| Solubility | Soluble in water, alcohol, ether, and benzene. |
| SMILES | C1=CC=NC(=C1)C#N |
| InChIKey | FFNVQNRYTPFDDP-UHFFFAOYSA-N |
Product Description
Applications: Pyridine-2-carbonitrile is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Pyridine-2-carbonitrile (CAS 100-70-9) is a heterocyclic building block with the molecular formula C6H4N2 and a molecular weight of 104.04 g/mol. Key physical properties include a density of 1.0810 @ 25 °C g/cm³, a solubility: Soluble in water, alcohol, ether, and benzene. Synonyms include 2-Cyanopyridine and Picolinonitrile.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Pyridine-2-carbonitrile
Property Insights of Pyridine-2-carbonitrile
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridine-2-carbonitrile. With a topological polar surface area (TPSA) of 36.7 Ų, Pyridine-2-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridine-2-carbonitrile has 0 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 Pyridine-2-carbonitrile?
The CAS number of Pyridine-2-carbonitrile is 100-70-9.
What is the molecular formula of Pyridine-2-carbonitrile?
The molecular formula of Pyridine-2-carbonitrile is C6H4N2.
What is the molecular weight of Pyridine-2-carbonitrile?
The molecular weight of Pyridine-2-carbonitrile is 104.037445 g/mol.
What are the applications of Pyridine-2-carbonitrile?
Pyridine-2-carbonitrile is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Pyridine-2-carbonitrile?
You can request a quote for Pyridine-2-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pyridine-2-carbonitrile?
Yes, CoreyChem provides custom synthesis services for Pyridine-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.