TL;DR: Benzenediazonium, 2-chloro-4-nitro-, sulfate (2:1) (CAS 68391-43-5) is a chemical compound with molecular formula C12H6Cl2N6O8S and molecular weight 463.93448 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(2-chloro-4-nitrobenzenediazonium);sulfate
Also Known As: 2-Chloro-4-nitroaniline diazonium sulfate, C6H3ClN3O2.1/2O4S, Benzenediazonium, 2-chloro-4-nitro-, sulfate (2:1), 2-chloro-4-nitrobenzenediazonium sulfate, bis(2-chloro-4-nitrobenzenediazonium) sulfate
| Molecular Formula | C12H6Cl2N6O8S |
| Molecular Weight | 463.93448 g/mol |
| XLogP | 4.13 |
| Topological Polar Surface Area (TPSA) | 237.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 0 |
| Exact Mass | 463.93448 Da |
| Heavy Atoms | 29 |
| Complexity | 293.0 |
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])Cl)[N+]#N.C1=CC(=C(C=C1[N+](=O)[O-])Cl)[N+]#N.[O-]S(=O)(=O)[O-] |
| InChIKey | ZCJWMAWJAJTAEO-UHFFFAOYSA-L |
The XLogP value of 4.13 indicates that Benzenediazonium, 2-chloro-4-nitro-, sulfate (2:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 237.0 Ų indicates high polarity, suggesting Benzenediazonium, 2-chloro-4-nitro-, sulfate (2:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzenediazonium, 2-chloro-4-nitro-, sulfate (2:1) has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzenediazonium, 2-chloro-4-nitro-, sulfate (2:1) is 68391-43-5.
The molecular formula of Benzenediazonium, 2-chloro-4-nitro-, sulfate (2:1) is C12H6Cl2N6O8S.
The molecular weight of Benzenediazonium, 2-chloro-4-nitro-, sulfate (2:1) is 463.93448 g/mol.
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