TL;DR: 1,2,5-Oxadiazole, 3,3'-oxybis[4-nitro- (CAS 152845-81-3) is a chemical compound with molecular formula C4N6O7 and molecular weight 243.98285 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-nitro-4-[(4-nitro-1,2,5-oxadiazol-3-yl)oxy]-1,2,5-oxadiazole
Also Known As: 4,4'-dinitrodifurazanyl ether, ZERO/008167, 3,3 -Oxybis(4-nitrofurazan), 1,2,5-Oxadiazole, 3,3'-oxybis[4-nitro-, 3,3'-Oxybis(4-nitro-1,2,5-oxadiazole)
| Molecular Formula | C4N6O7 |
| Molecular Weight | 243.98285 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 179.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.98285 Da |
| Heavy Atoms | 17 |
| Complexity | 284.0 |
| SMILES | C1(=NON=C1OC2=NON=C2[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | RBJTZDYBYKLCGS-UHFFFAOYSA-N |
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,5-Oxadiazole, 3,3'-oxybis[4-nitro-. The TPSA of 179.0 Ų indicates high polarity, suggesting 1,2,5-Oxadiazole, 3,3'-oxybis[4-nitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,2,5-Oxadiazole, 3,3'-oxybis[4-nitro- has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,2,5-Oxadiazole, 3,3'-oxybis[4-nitro- is 152845-81-3.
The molecular formula of 1,2,5-Oxadiazole, 3,3'-oxybis[4-nitro- is C4N6O7.
The molecular weight of 1,2,5-Oxadiazole, 3,3'-oxybis[4-nitro- is 243.98285 g/mol.
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