3-bromo-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Base Information

Chemical Name:3-bromo-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CAS No.:83255-87-2
Molecular Formula:C6H6BrN5
Molecular Weight:228.051
Hs Code.:
European Community (EC) Number:869-549-9
ChEMBL ID:CHEMBL4561429
DSSTox Substance ID:DTXSID701216598
Mol file:83255-87-2.mol

Synonyms:3-bromo-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine;83255-87-2;3-bromo-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;SCHEMBL869057;CHEMBL4561429;DHFYKLULHRGVSL-UHFFFAOYSA-N;DTXSID701216598;AKOS022656396;EN300-106669;3-Bromo-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-ylamine

Suppliers and Price of 3-bromo-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
3-Bromo-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
10mg
$ 65.00

Total 5 raw suppliers

Chemical Property of 3-bromo-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Chemical Property:

Melting Point:221-223 °C(Solv: ethanol (64-17-5))
Boiling Point:410.4±40.0 °C(Predicted)
PKA:3.46±0.30(Predicted)
PSA：69.62000
Density:2.16±0.1 g/cm3(Predicted)
LogP:1.28920
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:0
Exact Mass:226.98066
Heavy Atom Count:12
Complexity:177

Purity/Quality:

97% ^*data from raw suppliers

3-Bromo-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C2=NC=NC(=C2C(=N1)Br)N

Technology Process of 3-bromo-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine

There total 1 articles about 3-bromo-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine 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:

: 5399-92-8
4-chloro-1H-pyrazolo[3,4-d]pyrimidine

: 83255-87-2
3-bromo-1-methyl-4-aminopyrazolo<3,4-d>pyrimidine

Guidance literature:: Multi-step reaction with 3 steps

1.1: N-Bromosuccinimide / N,N-dimethyl-formamide / 3 h / 0 - 20 °C

2.1: sodium hydride / N,N-dimethyl-formamide / 0.25 h / 0 °C

2.2: 3 h / 0 - 20 °C

3.1: ammonium hydroxide / 1,4-dioxane / 100 °C / Autoclave

With ammonium hydroxide; N-Bromosuccinimide; sodium hydride; In 1,4-dioxane; N,N-dimethyl-formamide;

Reference yield: 82.0%

: 83255-87-2
3-bromo-1-methyl-4-aminopyrazolo<3,4-d>pyrimidine

: 214360-73-3
4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)aniline

: 1135429-59-2
3-(4-aminophenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Guidance literature:: With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; sodium hydrogencarbonate; In 1,4-dioxane; water; at 100 ℃; for 2h; Sealed tube;

Reference yield: 44.0%

: 819057-45-9
3-fluoro-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenylamine

: 83255-87-2
3-bromo-1-methyl-4-aminopyrazolo<3,4-d>pyrimidine

: 3-(4-amino-2-fluoro-phenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-ylamine

Guidance literature:: With dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; caesium carbonate; In 1,4-dioxane; water; at 100 ℃; Inert atmosphere;