3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium
TL;DR: 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium (CAS 75184-02-0) is a chemical compound with molecular formula C6H2N6O5+2 and molecular weight 238.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium
Also Known As: Cyclohexadienone, 4(or 6)-diazo-2,6(or 2,4)-dinitro-, 3,5-dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium
| Molecular Formula | C6H2N6O5+2 |
|---|---|
| Molecular Weight | 238.01 g/mol |
| LogP | 0.29276 |
| Topological Polar Surface Area | 159.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.00867 |
| Heavy Atoms | 17 |
| Complexity | 524.68384 |
Chemical Identifiers
| CAS Number | 75184-02-0 |
|---|---|
| SMILES | C1=C(C(=O)C(=CC1([N+]#N)[N+]#N)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium (CAS 75184-02-0), with molecular formula C6H2N6O5+2 and molecular weight 238.01 g/mol. IUPAC: 3,5-dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium.
Chemical Property Profile of 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium
Property Insights of 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium
The XLogP value of 0.29276 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium. The TPSA of 159.65 Ų indicates high polarity, suggesting 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium has 0 hydrogen bond donor(s) and 7 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-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium?
The CAS number of 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium is 75184-02-0.
What is the molecular formula of 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium?
The molecular formula of 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium is C6H2N6O5+2.
What is the molecular weight of 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium?
The molecular weight of 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium is 238.01 g/mol.
Where can I buy 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium?
You can request a quote for 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dinitro-4-oxocyclohexa-2,5-diene-1,1-didiazonium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.