4-(1-Phenylethenyl)pyridine
TL;DR: 4-(1-Phenylethenyl)pyridine (CAS 54813-56-8) is a chemical compound with molecular formula C13H11N and molecular weight 181.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-phenylethenyl)pyridine
Also Known As: 4-(1-Phenylethenyl)pyridine, alpha-(4-Pyridyl)styrene, 4-(1-Phenylvinyl)pyridine, Pyridine,4-(1-phenylethenyl)-, 4-(1-Phenylethen-1-yl)pyridine
| Molecular Formula | C13H11N |
|---|---|
| Molecular Weight | 181.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.08914 |
| Heavy Atoms | 14 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 54813-56-8 |
|---|---|
| SMILES | C=C(C1=CC=CC=C1)C2=CC=NC=C2 |
| InChIKey | XBAWKLVZIKCQEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(1-Phenylethenyl)pyridine (CAS 54813-56-8), with molecular formula C13H11N and molecular weight 181.09 g/mol. IUPAC: 4-(1-phenylethenyl)pyridine.
Chemical Property Profile of 4-(1-Phenylethenyl)pyridine
Property Insights of 4-(1-Phenylethenyl)pyridine
The XLogP value of 3.5 indicates that 4-(1-Phenylethenyl)pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.9 Ų, 4-(1-Phenylethenyl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1-Phenylethenyl)pyridine 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-(1-Phenylethenyl)pyridine?
The CAS number of 4-(1-Phenylethenyl)pyridine is 54813-56-8.
What is the molecular formula of 4-(1-Phenylethenyl)pyridine?
The molecular formula of 4-(1-Phenylethenyl)pyridine is C13H11N.
What is the molecular weight of 4-(1-Phenylethenyl)pyridine?
The molecular weight of 4-(1-Phenylethenyl)pyridine is 181.09 g/mol.
Where can I buy 4-(1-Phenylethenyl)pyridine?
You can request a quote for 4-(1-Phenylethenyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1-Phenylethenyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 4-(1-Phenylethenyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.