AC1NSXRM
1',3'-dihydroxyspiro[2,5-dihydro-[1,2,4]triazolo[4,3-b][1,2,4,5]tetrazine-6,2'-indene]-3-thione
Also Known As: CBMicro_026843|BIM-0026580.P001|1',3'-dihydroxyspiro[2,5-dihydro-[1,2,4]triazolo[4,3-b][1,2,4,5]tetrazine-6,2'-indene]-3-thione|1,3-Dihydroxy-5'H-spiro[indene-2,6'-[1,2,4]triazolo[4,3-b][1,2,4,5]tetrazine]-3'(2'H)-thione
CAS: 5627-95-2
| Molecular Formula | C11H8N6O2S |
|---|---|
| Molecular Weight | 288.04294 g/mol |
| LogP | 0.32399 |
| Topological Polar Surface Area | 110.82 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 288.04294 |
| Monoisotopic Mass | 288.04294 |
| Heavy Atoms | 20 |
| Complexity | 899.30835 |
Chemical Identifiers
| CAS Number | 5627-95-2 |
|---|---|
| SMILES | C1=CC2=C(C3(C(=C2C=C1)O)NN4C(=S)NN=C4N=N3)O |
Product Overview
AC1NSXRM (CAS 5627-95-2), with molecular formula C11H8N6O2S and molecular weight 288.04294 g/mol. IUPAC: 1',3'-dihydroxyspiro[2,5-dihydro-[1,2,4]triazolo[4,3-b][1,2,4,5]tetrazine-6,2'-indene]-3-thione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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