4-((4-Methoxybenzylidene)amino)benzonitrile
TL;DR: 4-((4-Methoxybenzylidene)amino)benzonitrile (CAS 13036-19-6) is a chemical compound with molecular formula C15H12N2O and molecular weight 236.09496 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4-methoxyphenyl)methylideneamino]benzonitrile
Also Known As: 4-[(4-Methoxybenzylidene)amino]benzonitrile, p-Methoxybenzylidene p-cyanoaniline, CPiMeOP, 4-(p-Anisalamino)benzonitrile, p-Anisylidene-p-cyanoaniline
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H12N2O |
| Molecular Weight | 236.09496 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 45.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.09496 Da |
| Heavy Atoms | 18 |
| Complexity | 315.0 |
| SMILES | COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C#N |
| InChIKey | SZTAFPBCQLNZQR-UHFFFAOYSA-N |
Chemical Property Profile of 4-((4-Methoxybenzylidene)amino)benzonitrile
Property Insights of 4-((4-Methoxybenzylidene)amino)benzonitrile
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((4-Methoxybenzylidene)amino)benzonitrile. With a topological polar surface area (TPSA) of 45.4 Ų, 4-((4-Methoxybenzylidene)amino)benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((4-Methoxybenzylidene)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-Methoxybenzylidene)amino)benzonitrile?
The CAS number of 4-((4-Methoxybenzylidene)amino)benzonitrile is 13036-19-6.
What is the molecular formula of 4-((4-Methoxybenzylidene)amino)benzonitrile?
The molecular formula of 4-((4-Methoxybenzylidene)amino)benzonitrile is C15H12N2O.
What is the molecular weight of 4-((4-Methoxybenzylidene)amino)benzonitrile?
The molecular weight of 4-((4-Methoxybenzylidene)amino)benzonitrile is 236.09496 g/mol.
Where can I buy 4-((4-Methoxybenzylidene)amino)benzonitrile?
You can request a quote for 4-((4-Methoxybenzylidene)amino)benzonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-((4-Methoxybenzylidene)amino)benzonitrile?
Yes, CoreyChem provides custom synthesis services for 4-((4-Methoxybenzylidene)amino)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.