2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile
TL;DR: 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile (CAS 91591-63-8) is a chemical compound with molecular formula C8H6Cl2N2 and molecular weight 199.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dichloro-4,6-dimethylpyridine-3-carbonitrile
Also Known As: 2,5-Dichloro-4,6-dimethylnicotinonitrile, 2,5-dichloro-4,6-dimethylpyridine-3-carbonitrile, 2,5-Dichloro-4,6-dimethyl-3-pyridinecarbonitrile, 2,5-dichloro-3-cyano-4,6-dimethylpyridine, 3-Cyano-2,5-dichloro-4,6-dimethylpyridine
| Molecular Formula | C8H6Cl2N2 |
|---|---|
| Molecular Weight | 199.99 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 36.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 199.9908 |
| Heavy Atoms | 12 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 91591-63-8 |
|---|---|
| SMILES | CC1=C(C(=NC(=C1Cl)C)Cl)C#N |
| InChIKey | UCGWYTUBYASPFG-UHFFFAOYSA-N |
Product Overview
2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile (CAS 91591-63-8), with molecular formula C8H6Cl2N2 and molecular weight 199.99 g/mol. IUPAC: 2,5-dichloro-4,6-dimethylpyridine-3-carbonitrile.
Chemical Property Profile of 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile
Property Insights of 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile. With a topological polar surface area (TPSA) of 36.7 Ų, 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dichloro-4,6-dimethylpyridine-3-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 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile?
The CAS number of 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile is 91591-63-8.
What is the molecular formula of 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile?
The molecular formula of 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile is C8H6Cl2N2.
What is the molecular weight of 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile?
The molecular weight of 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile is 199.99 g/mol.
Where can I buy 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile?
You can request a quote for 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dichloro-4,6-dimethylpyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.