Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1)
TL;DR: Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1) (CAS 68391-50-4) is a chemical compound with molecular formula C12H4Br2N8O12S and molecular weight 641.80 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-bromo-4,6-dinitrobenzenediazonium);sulfate
Also Known As: Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1), 6-Bromo-2,4-dinitroaniline diazonium sulfate, 2-bromo-4,6-dinitrobenzenediazonium sulfate, bis(2-bromo-4,6-dinitrobenzenediazonium) sulfate, 2-Bromo-4,6-dinitrobenzenediazonium sulphate (2:1)
| Molecular Formula | C12H4Br2N8O12S |
|---|---|
| Molecular Weight | 641.80 g/mol |
| LogP | 4.16 |
| Topological Polar Surface Area | 328.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 0 |
| Exact Mass | 643.8016 |
| Heavy Atoms | 35 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 68391-50-4 |
|---|---|
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])[N+]#N)Br)[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])[N+]#N)Br)[N+](=O)[O-].[O-]S(=O)(=O)[O-] |
| InChIKey | QRVCCIJHGQFIBC-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1) (CAS 68391-50-4), with molecular formula C12H4Br2N8O12S and molecular weight 641.80 g/mol. IUPAC: bis(2-bromo-4,6-dinitrobenzenediazonium);sulfate.
Chemical Property Profile of Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1)
Property Insights of Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1)
The XLogP value of 4.16 indicates that Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 328.0 Ų indicates high polarity, suggesting Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1) has 0 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1)?
The CAS number of Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1) is 68391-50-4.
What is the molecular formula of Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1)?
The molecular formula of Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1) is C12H4Br2N8O12S.
What is the molecular weight of Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1)?
The molecular weight of Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1) is 641.80 g/mol.
Where can I buy Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1)?
You can request a quote for Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzenediazonium, 2-bromo-4,6-dinitro-, sulfate (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.