HuagongsheHuagongshe Chemistry Print Report · For research reference only
Acetic Acid → 1-Methyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | Acetic Acid | HCID 176 | — |
| Reactant | Methylhydrazine | HCID 6061 | — |
| Reactant | 2-[(Dimethylamino)methylidene]cyclohexane-1,3-dione | HCID 359353 | — |
| Solvent | tert-Butanol | HCID 6386 | — |
| Product | 1-Methyl-1,5,6,7-tetrahydro-4H-indazol-4-one | HCID 2765796 | 44.4% |
Reaction Steps
To a solution of 2-((dimethylamino)methylene)cyclohexane-1,3-dione (55 g crude, 300 mmol) in t-BuOH (400 ml) was added methylhydrazine solution (35 g, 40% aqueous solution, 304 mmol) and AcOH (20 ml) at room temperature. The resulting mixture was heated to reflux for 3 h under nitrogen protection. After cooling, the mixture was concentrated in vacuo and the residue was purified by column chromatograph on silica gel (petroleum ether/ethyl acetate=1/1 v/v %) to give 1-methyl-6,7-dihydro-1H-indazol-4(5H)-one (20 g, two steps: 44%). MS-ESI (m/z): 151 (M+1)+ (Acq Method: 0-60AB_2 min; Rt: 0.90 min)
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US09446130B2 |
| Source dataset | uspto-grants-2016_09 |
| ORD ID | ord-c91a85ec21ff40dc99f2dd9f138c943d |
| Source note | uspto-grants-2016_09 |