8-methyl-5,5a,7,8-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-e]indole-6,8a-diol 3-oxide
6-hydroxy-8-methyl-3-oxido-5,5a,7,8-tetrahydro-4H-pyrrolo[2,3-g][2,1,3]benzoxadiazol-3-ium-8a-ol
Also Known As: Oprea1_584456|CBDivE_016220|VHHYIVAIZVRWGA-UHFFFAOYSA-|BAS 00637893|AG-690/37046097|8-methyl-5,5a,7,8-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-e]indole-6,8a-diol 3-oxide|8-Methyl-3-oxy-5,5a,7,8-tetrahydro-4H-2-oxa-1,3,6-triaza-as-indacene-6,8a-diol|6-hydroxy-8-methyl-3-oxido-5,5a,7,8-tetrahydro-4H-pyrrolo[2,3-g][2,1,3]benzoxadiazol-3-ium-8a-ol|6,8a-dihydroxy-8-methyl-5,5a,6,7,8,8a-hexahydro-4H-[1,2,5]oxadiazolo[3,4-e]indole 3-oxide
| Molecular Formula | C9H13N3O4 |
|---|---|
| Molecular Weight | 227.0906 g/mol |
| LogP | -0.8487 |
| Topological Polar Surface Area | 96.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 227.0906 |
| Monoisotopic Mass | 227.0906 |
| Heavy Atoms | 16 |
| Complexity | 434.38864 |
Chemical Identifiers
| CAS Number | 465535-01-7 |
|---|---|
| SMILES | CC1CN(C2C1(C3=NO[N+](=C3CC2)[O-])O)O |
Product Overview
8-methyl-5,5a,7,8-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-e]indole-6,8a-diol 3-oxide (CAS 465535-01-7), with molecular formula C9H13N3O4 and molecular weight 227.0906 g/mol. IUPAC: 6-hydroxy-8-methyl-3-oxido-5,5a,7,8-tetrahydro-4H-pyrrolo[2,3-g][2,1,3]benzoxadiazol-3-ium-8a-ol.
8-methyl-5,5a,7,8-tetrahydro-4H-[1,2,5]oxadiazolo[3,4-e]indole-6,8a-diol 3-oxide is a custom synthesis product. We offer services from milligram to kilogram scale.
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