3-(4-Pyridyl)propenal
TL;DR: 3-(4-Pyridyl)propenal (CAS 26505-36-2) is a chemical compound with molecular formula C8H7NO and molecular weight 133.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-pyridin-4-ylprop-2-enal
Also Known As: 3-(4-pyridyl)acrolein, 3-(4-pyridyl)propenal, 3-Pyridin-4-ylacrolein, 3-(pyridin-4-yl)prop-2-enal, 3-pyridin-4-yl-2-propen-1-one
| Molecular Formula | C8H7NO |
|---|---|
| Molecular Weight | 133.05 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 133.05276 |
| Heavy Atoms | 10 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 26505-36-2 |
|---|---|
| SMILES | C1=CN=CC=C1C=CC=O |
| InChIKey | PEIRJCZXFPMXTI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(4-Pyridyl)propenal (CAS 26505-36-2), with molecular formula C8H7NO and molecular weight 133.05 g/mol. IUPAC: 3-pyridin-4-ylprop-2-enal.
Chemical Property Profile of 3-(4-Pyridyl)propenal
Property Insights of 3-(4-Pyridyl)propenal
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Pyridyl)propenal. With a topological polar surface area (TPSA) of 30.0 Ų, 3-(4-Pyridyl)propenal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Pyridyl)propenal 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
Frequently Asked Questions
What is the CAS number of 3-(4-Pyridyl)propenal?
The CAS number of 3-(4-Pyridyl)propenal is 26505-36-2.
What is the molecular formula of 3-(4-Pyridyl)propenal?
The molecular formula of 3-(4-Pyridyl)propenal is C8H7NO.
What is the molecular weight of 3-(4-Pyridyl)propenal?
The molecular weight of 3-(4-Pyridyl)propenal is 133.05 g/mol.
Where can I buy 3-(4-Pyridyl)propenal?
You can request a quote for 3-(4-Pyridyl)propenal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Pyridyl)propenal?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Pyridyl)propenal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.