2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione
TL;DR: 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione (CAS 162228-86-6) is a chemical compound with molecular formula C16H12N2O4 and molecular weight 296.0797 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,6-dimethylphenyl)-4-nitroisoindole-1,3-dione
Also Known As: 2-(2,6-dimethylphenyl)-4-nitroisoindole-1,3-dione, N-(2,6-Dimethylphenyl)-3-nitrophthalimide, 2-(2,6-dimethylphenyl)-4-nitro-1H-isoindole-1,3(2H)-dione, 2-(2,6-Dimethyl-phenyl)-4-nitro-isoindole-1,3-dione, 2-(2,6-dimethylphenyl)-4-nitro-2,3-dihydro-1H-isoindole-1,3-dione
Technical Specifications
| Molecular Formula | C16H12N2O4 |
| Molecular Weight | 296.0797 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 83.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 296.0797 Da |
| Heavy Atoms | 22 |
| Complexity | 491.0 |
| SMILES | CC1=C(C(=CC=C1)C)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-] |
| InChIKey | HEMNMVRZSYQCJL-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione
Property Insights of 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione
The XLogP value of 3.0 indicates that 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione. Following Lipinski's Rule of Five, 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione 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
What is the CAS number of 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione?
The CAS number of 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione is 162228-86-6.
What is the molecular formula of 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione?
The molecular formula of 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione is C16H12N2O4.
What is the molecular weight of 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione?
The molecular weight of 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione is 296.0797 g/mol.
Where can I buy 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione?
You can request a quote for 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione?
Yes, CoreyChem provides custom synthesis services for 2-(2,6-Dimethylphenyl)-4-nitroisoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.