![4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile structure](/static/products/1485/148515-57-5.webp)
4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile
TL;DR: 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile (CAS 148515-57-5) is a chemical compound with molecular formula C16H9ClN2 and molecular weight 264.04544 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile
Also Known As: 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile
Technical Specifications
| Molecular Formula | C16H9ClN2 |
| Molecular Weight | 264.04544 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.04544 Da |
| Heavy Atoms | 19 |
| Complexity | 420.0 |
| SMILES | C1=CC(=CC=C1/C=C(/C#N)\C2=CC=C(C=C2)Cl)C#N |
| InChIKey | DZUGAAWYSGCPPI-DHDCSXOGSA-N |
Chemical Property Profile of 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile
Property Insights of 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile
The XLogP value of 4.0 indicates that 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]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 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile?
The CAS number of 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile is 148515-57-5.
What is the molecular formula of 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile?
The molecular formula of 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile is C16H9ClN2.
What is the molecular weight of 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile?
The molecular weight of 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile is 264.04544 g/mol.
Where can I buy 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile?
You can request a quote for 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile?
Yes, CoreyChem provides custom synthesis services for 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.