Dinofenate
TL;DR: Dinofenate (CAS 61614-62-8) is a chemical compound with molecular formula C17H14N4O11 and molecular weight 450.06592 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-butan-2-yl-4,6-dinitrophenyl) (2,4-dinitrophenyl) carbonate
Also Known As: Dinofenate, Tribonate, Dinofenate [BSI], carbonate, Dinofenat
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H14N4O11 |
| Molecular Weight | 450.06592 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 219.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.06592 Da |
| Heavy Atoms | 32 |
| Complexity | 741.0 |
| SMILES | CCC(C)C1=C(C(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-])OC(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | HEJVROKEIMJTIN-UHFFFAOYSA-N |
Chemical Property Profile of Dinofenate
Property Insights of Dinofenate
The XLogP value of 4.6 indicates that Dinofenate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 219.0 Ų indicates high polarity, suggesting Dinofenate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dinofenate has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Dinofenate?
The CAS number of Dinofenate is 61614-62-8.
What is the molecular formula of Dinofenate?
The molecular formula of Dinofenate is C17H14N4O11.
What is the molecular weight of Dinofenate?
The molecular weight of Dinofenate is 450.06592 g/mol.
Where can I buy Dinofenate?
You can request a quote for Dinofenate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dinofenate?
Yes, CoreyChem provides custom synthesis services for Dinofenate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.