3,3-dichloro-6-nitro-1H-quinoline-2,4-dione
TL;DR: 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione (CAS 102249-20-7) is a chemical compound with molecular formula C9H4Cl2N2O4 and molecular weight 273.9548 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,3-dichloro-6-nitro-1H-quinoline-2,4-dione
Also Known As: 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione
Technical Specifications
| Molecular Formula | C9H4Cl2N2O4 |
| Molecular Weight | 273.9548 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 92.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 273.9548 Da |
| Heavy Atoms | 17 |
| Complexity | 393.0 |
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(C(=O)N2)(Cl)Cl |
| InChIKey | RTIYVIHFKBPDBN-UHFFFAOYSA-N |
Chemical Property Profile of 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione
Property Insights of 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione. The TPSA of 92.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione. Following Lipinski's Rule of Five, 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione?
The CAS number of 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione is 102249-20-7.
What is the molecular formula of 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione?
The molecular formula of 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione is C9H4Cl2N2O4.
What is the molecular weight of 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione?
The molecular weight of 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione is 273.9548 g/mol.
Where can I buy 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione?
You can request a quote for 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione?
Yes, CoreyChem provides custom synthesis services for 3,3-dichloro-6-nitro-1H-quinoline-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.