TL;DR: Dinitrosoglycolurile (CAS 157203-19-5) is a chemical compound with molecular formula C8H8N12O8 and molecular weight 400.0588 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4-dinitroso-1,3a,6,6a-tetrahydroimidazo[4,5-d]imidazole-2,5-dione;3,6-dinitroso-1,3a,4,6a-tetrahydroimidazo[4,5-d]imidazole-2,5-dione
Also Known As: Dinitrosoglycolurile, DNSGU, Decanoyl fluoride,octadecafluoro-9-(trifluoromethyl), Dinitrosotetrahydroimidazo(4,5-d)imidazole-2,5(1H,3H)-dione mixt., Dinitrosotetrahydroimidazo(4,5-d)imidazole-2,5(1H,3H)-dione
| Molecular Formula | C8H8N12O8 |
| Molecular Weight | 400.0588 g/mol |
| XLogP | -1.8964 |
| Topological Polar Surface Area (TPSA) | 247.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 0 |
| Exact Mass | 400.0588 Da |
| Heavy Atoms | 28 |
| Complexity | 598.0 |
| SMILES | C12C(N(C(=O)N1)N=O)N(C(=O)N2)N=O.C12C(NC(=O)N1N=O)N(C(=O)N2)N=O |
| InChIKey | KOYQMJBNKAOSGP-UHFFFAOYSA-N |
The XLogP value of -1.8964 indicates that Dinitrosoglycolurile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 247.0 Ų indicates high polarity, suggesting Dinitrosoglycolurile may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dinitrosoglycolurile has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Dinitrosoglycolurile is 157203-19-5.
The molecular formula of Dinitrosoglycolurile is C8H8N12O8.
The molecular weight of Dinitrosoglycolurile is 400.0588 g/mol.
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