3-Pyridinecarboxaldehyde
TL;DR: 3-Pyridinecarboxaldehyde (CAS 500-22-1) is a chemical compound with molecular formula C6H5NO and molecular weight 107.03712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pyridine-3-carbaldehyde
Also Known As: 3-Pyridinecarboxaldehyde, Nicotinaldehyde, Pyridine-3-carbaldehyde, 3-Pyridinaldehyde, Nicotinic aldehyde
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H5NO |
| Molecular Weight | 107.03712 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 107.03712 Da |
| Heavy Atoms | 8 |
| Complexity | 82.0 |
| Vapor Pressure | 0.56 [mmHg] |
| SMILES | C1=CC(=CN=C1)C=O |
| InChIKey | QJZUKDFHGGYHMC-UHFFFAOYSA-N |
Product Description
Applications: 3-Pyridinecarboxaldehyde is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A heterocyclic building block supplied by CoreyChem, 3-Pyridinecarboxaldehyde (CAS 500-22-1) has the molecular formula C6H5NO and a molecular weight of 107.04 g/mol. Synonyms include 3-Pyridinecarboxaldehyde and Nicotinaldehyde.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 3-Pyridinecarboxaldehyde
Property Insights of 3-Pyridinecarboxaldehyde
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridinecarboxaldehyde. With a topological polar surface area (TPSA) of 30.0 Ų, 3-Pyridinecarboxaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyridinecarboxaldehyde 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 3-Pyridinecarboxaldehyde?
The CAS number of 3-Pyridinecarboxaldehyde is 500-22-1.
What is the molecular formula of 3-Pyridinecarboxaldehyde?
The molecular formula of 3-Pyridinecarboxaldehyde is C6H5NO.
What is the molecular weight of 3-Pyridinecarboxaldehyde?
The molecular weight of 3-Pyridinecarboxaldehyde is 107.03712 g/mol.
What are the applications of 3-Pyridinecarboxaldehyde?
3-Pyridinecarboxaldehyde is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy 3-Pyridinecarboxaldehyde?
You can request a quote for 3-Pyridinecarboxaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Pyridinecarboxaldehyde?
Yes, CoreyChem provides custom synthesis services for 3-Pyridinecarboxaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.