1-(4-Fluorophenyl)-1,5,6,7-tetrahydro-6,6-dimethyl-4H-indazol-4-one

Base Information

Chemical Name:1-(4-Fluorophenyl)-1,5,6,7-tetrahydro-6,6-dimethyl-4H-indazol-4-one
CAS No.:37858-91-6
Molecular Formula:C₁₅H₁₅FN₂O
Molecular Weight:258.295
Hs Code.:
DSSTox Substance ID:DTXSID401163322

Synonyms:DTXSID401163322;AKOS014692265;SR-01000496461;SR-01000496461-1;1-(4-Fluorophenyl)-1,5,6,7-tetrahydro-6,6-dimethyl-4H-indazol-4-one;37858-91-6

Suppliers and Price of 1-(4-Fluorophenyl)-1,5,6,7-tetrahydro-6,6-dimethyl-4H-indazol-4-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 1-(4-Fluorophenyl)-1,5,6,7-tetrahydro-6,6-dimethyl-4H-indazol-4-one

Chemical Property:

XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:258.11684127
Heavy Atom Count:19
Complexity:363

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1(CC2=C(C=NN2C3=CC=C(C=C3)F)C(=O)C1)C

Technology Process of 1-(4-Fluorophenyl)-1,5,6,7-tetrahydro-6,6-dimethyl-4H-indazol-4-one

There total 4 articles about 1-(4-Fluorophenyl)-1,5,6,7-tetrahydro-6,6-dimethyl-4H-indazol-4-one which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 81.0%

: 37858-95-0
2-(4-fluorophenylhydrazinomethylene)-5,5-dimethyl-1,3-cyclohexanedione

: 37858-91-6
1-(4-fluorophenyl)-6,6-dimethyl-4-oxo-4,5,6,7-tetrahydroindazole

Guidance literature:: With hydrogenchloride; In ethanol; for 3h; Heating;
DOI:10.1007/BF02291647

Reference yield:

: 823-85-8
4-fluorophenyhydrazine hydrochloride

: 37858-91-6
1-(4-fluorophenyl)-6,6-dimethyl-4-oxo-4,5,6,7-tetrahydroindazole

Guidance literature:: Multi-step reaction with 2 steps

1: 77 percent / H₂O / 80 - 90 °C

2: 81 percent / HCl / ethanol / 3 h / Heating

With hydrogenchloride; In ethanol; water; 1: Condensation / 2: Cyclization;
DOI:10.1007/BF02291647

Reference yield:

: potassium salt of 2-formyldimedone

: 37858-91-6
1-(4-fluorophenyl)-6,6-dimethyl-4-oxo-4,5,6,7-tetrahydroindazole

Guidance literature:: Multi-step reaction with 2 steps

1: 77 percent / H₂O / 80 - 90 °C

2: 81 percent / HCl / ethanol / 3 h / Heating

With hydrogenchloride; In ethanol; water; 1: Condensation / 2: Cyclization;
DOI:10.1007/BF02291647