Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1)
TL;DR: Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1) (CAS 63589-34-4) is a chemical compound with molecular formula C12H10Br2Cl2N4O8S and molecular weight 597.80 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis((2-bromo-6-chloro-4-nitrophenyl)azanium);sulfate
Also Known As: Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1), C6H4BrClN2O2.1/2H2O4S, bis(2-bromo-6-chloro-4-nitroanilinium) sulfate, 11beta,17alpha-Dihydroxy-4-pregnene-3,20-dione, (2-bromo-6-chloro-4-nitrophenyl)azanium;sulfate
| Molecular Formula | C12H10Br2Cl2N4O8S |
|---|---|
| Molecular Weight | 597.80 g/mol |
| LogP | 2.43 |
| Topological Polar Surface Area | 236.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 599.79425 |
| Heavy Atoms | 29 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 63589-34-4 |
|---|---|
| SMILES | C1=C(C=C(C(=C1Cl)[NH3+])Br)[N+](=O)[O-].C1=C(C=C(C(=C1Cl)[NH3+])Br)[N+](=O)[O-].[O-]S(=O)(=O)[O-] |
| InChIKey | AMCVQXACBOZITO-UHFFFAOYSA-N |
Product Overview
Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1) (CAS 63589-34-4), with molecular formula C12H10Br2Cl2N4O8S and molecular weight 597.80 g/mol. IUPAC: bis((2-bromo-6-chloro-4-nitrophenyl)azanium);sulfate.
Chemical Property Profile of Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1)
Property Insights of Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1)
The XLogP value of 2.43 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1). The TPSA of 236.0 Ų indicates high polarity, suggesting Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1) has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1)?
The CAS number of Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1) is 63589-34-4.
What is the molecular formula of Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1)?
The molecular formula of Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1) is C12H10Br2Cl2N4O8S.
What is the molecular weight of Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1)?
The molecular weight of Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1) is 597.80 g/mol.
Where can I buy Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1)?
You can request a quote for Benzenamine, 2-bromo-6-chloro-4-nitro-, 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 Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, 2-bromo-6-chloro-4-nitro-, sulfate (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.