(2,6-Dinitrophenyl) acetate
TL;DR: (2,6-Dinitrophenyl) acetate (CAS 1523-09-7) is a chemical compound with molecular formula C8H6N2O6 and molecular weight 226.02258 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,6-dinitrophenyl) acetate
Also Known As: (2,6-dinitrophenyl) acetate, 2,6-Dinitro-phenylacetat, 2,6-DINITROPHENYL ACETATE
Technical Specifications
| Molecular Formula | C8H6N2O6 |
| Molecular Weight | 226.02258 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.02258 Da |
| Heavy Atoms | 16 |
| Complexity | 285.0 |
| SMILES | CC(=O)OC1=C(C=CC=C1[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | FNOLBMVTCDXXSP-UHFFFAOYSA-N |
Chemical Property Profile of (2,6-Dinitrophenyl) acetate
Property Insights of (2,6-Dinitrophenyl) acetate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,6-Dinitrophenyl) acetate. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,6-Dinitrophenyl) acetate. Following Lipinski's Rule of Five, (2,6-Dinitrophenyl) acetate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2,6-Dinitrophenyl) acetate?
The CAS number of (2,6-Dinitrophenyl) acetate is 1523-09-7.
What is the molecular formula of (2,6-Dinitrophenyl) acetate?
The molecular formula of (2,6-Dinitrophenyl) acetate is C8H6N2O6.
What is the molecular weight of (2,6-Dinitrophenyl) acetate?
The molecular weight of (2,6-Dinitrophenyl) acetate is 226.02258 g/mol.
Where can I buy (2,6-Dinitrophenyl) acetate?
You can request a quote for (2,6-Dinitrophenyl) acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2,6-Dinitrophenyl) acetate?
Yes, CoreyChem provides custom synthesis services for (2,6-Dinitrophenyl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.