3,5-Dinitrobenzene-1,2-diolate
TL;DR: 3,5-Dinitrobenzene-1,2-diolate (CAS 7659-29-2) is a chemical compound with molecular formula C6H2N2O6-2 and molecular weight 197.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dinitrobenzene-1,2-diolate
Also Known As: 3,5-dinitrobenzene-1,2-diolate
| Molecular Formula | C6H2N2O6-2 |
|---|---|
| Molecular Weight | 197.99 g/mol |
| LogP | -0.3498 |
| Topological Polar Surface Area | 132.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.99129 |
| Heavy Atoms | 14 |
| Complexity | 415.02792 |
Chemical Identifiers
| CAS Number | 7659-29-2 |
|---|---|
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[O-])[N+](=O)[O-] |
Product Overview
3,5-Dinitrobenzene-1,2-diolate (CAS 7659-29-2), with molecular formula C6H2N2O6-2 and molecular weight 197.99 g/mol. IUPAC: 3,5-dinitrobenzene-1,2-diolate.
Chemical Property Profile of 3,5-Dinitrobenzene-1,2-diolate
Property Insights of 3,5-Dinitrobenzene-1,2-diolate
The XLogP value of -0.3498 indicates that 3,5-Dinitrobenzene-1,2-diolate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 132.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dinitrobenzene-1,2-diolate. Following Lipinski's Rule of Five, 3,5-Dinitrobenzene-1,2-diolate 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
Frequently Asked Questions
What is the CAS number of 3,5-Dinitrobenzene-1,2-diolate?
The CAS number of 3,5-Dinitrobenzene-1,2-diolate is 7659-29-2.
What is the molecular formula of 3,5-Dinitrobenzene-1,2-diolate?
The molecular formula of 3,5-Dinitrobenzene-1,2-diolate is C6H2N2O6-2.
What is the molecular weight of 3,5-Dinitrobenzene-1,2-diolate?
The molecular weight of 3,5-Dinitrobenzene-1,2-diolate is 197.99 g/mol.
Where can I buy 3,5-Dinitrobenzene-1,2-diolate?
You can request a quote for 3,5-Dinitrobenzene-1,2-diolate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dinitrobenzene-1,2-diolate?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dinitrobenzene-1,2-diolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.