TL;DR: n-(2,6-Dichlorophenyl)-n-nitrosoacetamide (CAS 105661-47-0) is a chemical compound with molecular formula C8H6Cl2N2O2 and molecular weight 231.98064 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2,6-dichlorophenyl)-N-nitrosoacetamide
Also Known As: n-(2,6-dichlorophenyl)-n-nitrosoacetamide, N-(2,6-dichlorophenyl)-N-nitroso-acetamide, Acetamide,n-(2,6-dichlorophenyl)-n-nitroso-
| Molecular Formula | C8H6Cl2N2O2 |
| Molecular Weight | 231.98064 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 49.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.98064 Da |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
| SMILES | CC(=O)N(C1=C(C=CC=C1Cl)Cl)N=O |
| InChIKey | BQTHRSKVMIPKDE-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-(2,6-Dichlorophenyl)-n-nitrosoacetamide. With a topological polar surface area (TPSA) of 49.7 Ų, n-(2,6-Dichlorophenyl)-n-nitrosoacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-(2,6-Dichlorophenyl)-n-nitrosoacetamide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of n-(2,6-Dichlorophenyl)-n-nitrosoacetamide is 105661-47-0.
The molecular formula of n-(2,6-Dichlorophenyl)-n-nitrosoacetamide is C8H6Cl2N2O2.
The molecular weight of n-(2,6-Dichlorophenyl)-n-nitrosoacetamide is 231.98064 g/mol.
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