2-(2,4-Dichlorophenoxy)benzonitrile
TL;DR: 2-(2,4-Dichlorophenoxy)benzonitrile (CAS 1159826-44-4) is a chemical compound with molecular formula C13H7Cl2NO and molecular weight 262.99048 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,4-dichlorophenoxy)benzonitrile
Also Known As: 2-(2,4-dichlorophenoxy)benzonitrile, 3-Methoxypicolinaldehyde, Maybridge1_003221, 5173AJ, Benzonitrile,2-(2,4-dichlorophenoxy)-
Technical Specifications
| Molecular Formula | C13H7Cl2NO |
| Molecular Weight | 262.99048 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 33.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.99048 Da |
| Heavy Atoms | 17 |
| Complexity | 301.0 |
| SMILES | C1=CC=C(C(=C1)C#N)OC2=C(C=C(C=C2)Cl)Cl |
| InChIKey | UTLUAJUFCRYPDL-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2,4-Dichlorophenoxy)benzonitrile
Property Insights of 2-(2,4-Dichlorophenoxy)benzonitrile
The XLogP value of 4.4 indicates that 2-(2,4-Dichlorophenoxy)benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.0 Ų, 2-(2,4-Dichlorophenoxy)benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,4-Dichlorophenoxy)benzonitrile 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 2-(2,4-Dichlorophenoxy)benzonitrile?
The CAS number of 2-(2,4-Dichlorophenoxy)benzonitrile is 1159826-44-4.
What is the molecular formula of 2-(2,4-Dichlorophenoxy)benzonitrile?
The molecular formula of 2-(2,4-Dichlorophenoxy)benzonitrile is C13H7Cl2NO.
What is the molecular weight of 2-(2,4-Dichlorophenoxy)benzonitrile?
The molecular weight of 2-(2,4-Dichlorophenoxy)benzonitrile is 262.99048 g/mol.
Where can I buy 2-(2,4-Dichlorophenoxy)benzonitrile?
You can request a quote for 2-(2,4-Dichlorophenoxy)benzonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2,4-Dichlorophenoxy)benzonitrile?
Yes, CoreyChem provides custom synthesis services for 2-(2,4-Dichlorophenoxy)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.