![4-[(E)-2-Phenylethenyl]benzonitrile structure](/static/products/1304/13041-79-7.webp)
4-[(E)-2-Phenylethenyl]benzonitrile
TL;DR: 4-[(E)-2-Phenylethenyl]benzonitrile (CAS 13041-79-7) is a chemical compound with molecular formula C15H11N and molecular weight 205.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-phenylethenyl)benzonitrile
Also Known As: 4-Cyanostilbene, 4-styrylbenzonitrile, 4-stilbene-carbonitrile, Stilbene-4-carbonitrile, 4-(2-phenylethenyl)benzonitrile
| Molecular Formula | C15H11N |
|---|---|
| Molecular Weight | 205.09 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.08914 |
| Heavy Atoms | 16 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 13041-79-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC2=CC=C(C=C2)C#N |
| InChIKey | WQUHPLQCUQJSQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[(E)-2-Phenylethenyl]benzonitrile (CAS 13041-79-7), with molecular formula C15H11N and molecular weight 205.09 g/mol. IUPAC: 4-(2-phenylethenyl)benzonitrile.
Chemical Property Profile of 4-[(E)-2-Phenylethenyl]benzonitrile
Property Insights of 4-[(E)-2-Phenylethenyl]benzonitrile
The XLogP value of 4.2 indicates that 4-[(E)-2-Phenylethenyl]benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, 4-[(E)-2-Phenylethenyl]benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(E)-2-Phenylethenyl]benzonitrile has 0 hydrogen bond donor(s) and 1 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 4-[(E)-2-Phenylethenyl]benzonitrile?
The CAS number of 4-[(E)-2-Phenylethenyl]benzonitrile is 13041-79-7.
What is the molecular formula of 4-[(E)-2-Phenylethenyl]benzonitrile?
The molecular formula of 4-[(E)-2-Phenylethenyl]benzonitrile is C15H11N.
What is the molecular weight of 4-[(E)-2-Phenylethenyl]benzonitrile?
The molecular weight of 4-[(E)-2-Phenylethenyl]benzonitrile is 205.09 g/mol.
Where can I buy 4-[(E)-2-Phenylethenyl]benzonitrile?
You can request a quote for 4-[(E)-2-Phenylethenyl]benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(E)-2-Phenylethenyl]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[(E)-2-Phenylethenyl]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.