4-Chloro-3-nitro-1,2-dihydropyridin-2-one
TL;DR: 4-Chloro-3-nitro-1,2-dihydropyridin-2-one (CAS 1218764-78-3) is a chemical compound with molecular formula C5H3ClN2O3 and molecular weight 173.98322 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-3-nitro-1H-pyridin-2-one
Also Known As: 4-Chloro-2-hydroxy-3-nitropyridine, 4-chloro-3-nitropyridin-2-ol, 4-chloro-3-nitro-1H-pyridin-2-one, 4-Chloro-3-nitropyridone, 4-chloro-3-nitro-2(1h)-pyridinone
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H3ClN2O3 |
| Molecular Weight | 173.98322 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 173.98322 Da |
| Heavy Atoms | 11 |
| Complexity | 276.0 |
| SMILES | C1=CNC(=O)C(=C1Cl)[N+](=O)[O-] |
| InChIKey | UKIZCTHOMJXNIX-UHFFFAOYSA-N |
Chemical Property Profile of 4-Chloro-3-nitro-1,2-dihydropyridin-2-one
Property Insights of 4-Chloro-3-nitro-1,2-dihydropyridin-2-one
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-3-nitro-1,2-dihydropyridin-2-one. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-3-nitro-1,2-dihydropyridin-2-one. Following Lipinski's Rule of Five, 4-Chloro-3-nitro-1,2-dihydropyridin-2-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Chloro-3-nitro-1,2-dihydropyridin-2-one?
The CAS number of 4-Chloro-3-nitro-1,2-dihydropyridin-2-one is 1218764-78-3.
What is the molecular formula of 4-Chloro-3-nitro-1,2-dihydropyridin-2-one?
The molecular formula of 4-Chloro-3-nitro-1,2-dihydropyridin-2-one is C5H3ClN2O3.
What is the molecular weight of 4-Chloro-3-nitro-1,2-dihydropyridin-2-one?
The molecular weight of 4-Chloro-3-nitro-1,2-dihydropyridin-2-one is 173.98322 g/mol.
Where can I buy 4-Chloro-3-nitro-1,2-dihydropyridin-2-one?
You can request a quote for 4-Chloro-3-nitro-1,2-dihydropyridin-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Chloro-3-nitro-1,2-dihydropyridin-2-one?
Yes, CoreyChem provides custom synthesis services for 4-Chloro-3-nitro-1,2-dihydropyridin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.