3-Nitropicolinaldehyde
TL;DR: 3-Nitropicolinaldehyde (CAS 57266-69-0) is a chemical compound with molecular formula C6H4N2O3 and molecular weight 152.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitropyridine-2-carbaldehyde
Also Known As: 3-Nitropicolinaldehyde, 3-nitropyridine-2-carbaldehyde, 3-nitro-2-pyridinecarboxaldehyde, 2-PYRIDINECARBOXALDEHYDE, 3-NITRO-, 2-formyl-3-nitropyridine
| Molecular Formula | C6H4N2O3 |
|---|---|
| Molecular Weight | 152.02 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 75.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.02219 |
| Heavy Atoms | 11 |
| Complexity | 166.0 |
Chemical Identifiers
| CAS Number | 57266-69-0 |
|---|---|
| SMILES | C1=CC(=C(N=C1)C=O)[N+](=O)[O-] |
| InChIKey | ZERYBWXKTKFOBF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Nitropicolinaldehyde (CAS 57266-69-0), with molecular formula C6H4N2O3 and molecular weight 152.02 g/mol. IUPAC: 3-nitropyridine-2-carbaldehyde.
Chemical Property Profile of 3-Nitropicolinaldehyde
Property Insights of 3-Nitropicolinaldehyde
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Nitropicolinaldehyde. The TPSA of 75.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitropicolinaldehyde. Following Lipinski's Rule of Five, 3-Nitropicolinaldehyde has 0 hydrogen bond donor(s) and 4 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-Nitropicolinaldehyde?
The CAS number of 3-Nitropicolinaldehyde is 57266-69-0.
What is the molecular formula of 3-Nitropicolinaldehyde?
The molecular formula of 3-Nitropicolinaldehyde is C6H4N2O3.
What is the molecular weight of 3-Nitropicolinaldehyde?
The molecular weight of 3-Nitropicolinaldehyde is 152.02 g/mol.
Where can I buy 3-Nitropicolinaldehyde?
You can request a quote for 3-Nitropicolinaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitropicolinaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitropicolinaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.