4-((4-Ethoxybenzylidene)amino)benzonitrile
TL;DR: 4-((4-Ethoxybenzylidene)amino)benzonitrile (CAS 24742-30-1) is a chemical compound with molecular formula C16H14N2O and molecular weight 250.11061 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4-ethoxyphenyl)methylideneamino]benzonitrile
Also Known As: 4'-Ethoxybenzylidene-4-cyanoaniline, 4-((4-Ethoxybenzylidene)amino)benzonitrile, 4-Ethoxybenzylidene-4-cyanoaniline, CPi2OP, p-Ethoxybenzylidene p-cyanoaniline
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H14N2O |
| Molecular Weight | 250.11061 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 45.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.11061 Da |
| Heavy Atoms | 19 |
| Complexity | 328.0 |
| SMILES | CCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C#N |
| InChIKey | YFZISFITJTVAET-UHFFFAOYSA-N |
Chemical Property Profile of 4-((4-Ethoxybenzylidene)amino)benzonitrile
Property Insights of 4-((4-Ethoxybenzylidene)amino)benzonitrile
The XLogP value of 3.3 indicates that 4-((4-Ethoxybenzylidene)amino)benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.4 Ų, 4-((4-Ethoxybenzylidene)amino)benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((4-Ethoxybenzylidene)amino)benzonitrile 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
What is the CAS number of 4-((4-Ethoxybenzylidene)amino)benzonitrile?
The CAS number of 4-((4-Ethoxybenzylidene)amino)benzonitrile is 24742-30-1.
What is the molecular formula of 4-((4-Ethoxybenzylidene)amino)benzonitrile?
The molecular formula of 4-((4-Ethoxybenzylidene)amino)benzonitrile is C16H14N2O.
What is the molecular weight of 4-((4-Ethoxybenzylidene)amino)benzonitrile?
The molecular weight of 4-((4-Ethoxybenzylidene)amino)benzonitrile is 250.11061 g/mol.
Where can I buy 4-((4-Ethoxybenzylidene)amino)benzonitrile?
You can request a quote for 4-((4-Ethoxybenzylidene)amino)benzonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-((4-Ethoxybenzylidene)amino)benzonitrile?
Yes, CoreyChem provides custom synthesis services for 4-((4-Ethoxybenzylidene)amino)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.