HC-056456
[5-oxido-4-(thiophene-2-carbonyl)-1,2,5-oxadiazol-5-ium-3-yl]-thiophen-2-ylmethanone
Also Known As: regid856726|GTPL4212|IFLab1_001088|3,4-Bis(2-thenoyl)furazan 2-oxide|3,4-Bis<2-thienylcarbonyl>furazan-oxid|IDI1_008955|3,4-bis(2-thienoyl)-1,2,5-oxadiazole-N-oxide|NCGC00071855-02|NCGC00071855-03|3,4-Bis(2-thienylcarbonyl)furazan 2-oxide|3,4-Di(thiophene-2-carbonyl)-1,2,5-oxadiazole 2-oxide|3,4-bis(2-thienylcarbonyl)-1,2,5-oxadiazol-2-ium-2-olate|bis[(thiophen-2-yl)carbonyl]-1,2,5-oxadiazol-2-ium-2-olate|J1.672.926D|[5-oxido-4-(thiophene-2-carbonyl)-1,2,5-oxadiazol-5-ium-3-yl]-thiophen-2-ylmethanone|bis(thiophene-2-carbonyl)-1,2,5-oxadiazol-2-ium-2-olate|Methanone, (2-oxido-1,2,5-oxadiazole-3,4-diyl)bis[2-thienyl-
| Molecular Formula | C12H6N2O4S2 |
|---|---|
| Molecular Weight | 305.9769 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.9769 |
| Monoisotopic Mass | 305.9769 |
| Heavy Atoms | 20 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 7733-96-2 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)C2=NO[N+](=C2C(=O)C3=CC=CS3)[O-] |
| InChIKey | RUQGCDMXFBOTMW-UHFFFAOYSA-N |
Product Overview
HC-056456 (CAS 7733-96-2), with molecular formula C12H6N2O4S2 and molecular weight 305.9769 g/mol. IUPAC: [5-oxido-4-(thiophene-2-carbonyl)-1,2,5-oxadiazol-5-ium-3-yl]-thiophen-2-ylmethanone.