3,6-Dichloropyridine-2-carbonitrile
TL;DR: 3,6-Dichloropyridine-2-carbonitrile (CAS 1702-18-7) is a chemical compound with molecular formula C6H2Cl2N2 and molecular weight 171.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-dichloropyridine-2-carbonitrile
Also Known As: 3,6-Dichloropicolinonitrile, 3,6-dichloropyridine-2-carbonitrile, 2-CYANO-3,6-DICHLOROPYRIDINE, 3,6-DICHLORO-2-PYRIDINECARBONITRILE, 3,6-dichloro-2-cyanopyridine
| Molecular Formula | C6H2Cl2N2 |
|---|---|
| Molecular Weight | 171.96 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 36.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 171.9595 |
| Heavy Atoms | 10 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 1702-18-7 |
|---|---|
| SMILES | C1=CC(=NC(=C1Cl)C#N)Cl |
| InChIKey | AFSVHZPQZBOZDK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,6-Dichloropyridine-2-carbonitrile (CAS 1702-18-7), with molecular formula C6H2Cl2N2 and molecular weight 171.96 g/mol. IUPAC: 3,6-dichloropyridine-2-carbonitrile.
Chemical Property Profile of 3,6-Dichloropyridine-2-carbonitrile
Property Insights of 3,6-Dichloropyridine-2-carbonitrile
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Dichloropyridine-2-carbonitrile. With a topological polar surface area (TPSA) of 36.7 Ų, 3,6-Dichloropyridine-2-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Dichloropyridine-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
Frequently Asked Questions
What is the CAS number of 3,6-Dichloropyridine-2-carbonitrile?
The CAS number of 3,6-Dichloropyridine-2-carbonitrile is 1702-18-7.
What is the molecular formula of 3,6-Dichloropyridine-2-carbonitrile?
The molecular formula of 3,6-Dichloropyridine-2-carbonitrile is C6H2Cl2N2.
What is the molecular weight of 3,6-Dichloropyridine-2-carbonitrile?
The molecular weight of 3,6-Dichloropyridine-2-carbonitrile is 171.96 g/mol.
Where can I buy 3,6-Dichloropyridine-2-carbonitrile?
You can request a quote for 3,6-Dichloropyridine-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Dichloropyridine-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Dichloropyridine-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.