ChemicalBook--->CAS DataBase List--->6752-16-5

6752-16-5

6752-16-5 Structure

6752-16-5 Structure
IdentificationMore
[Name]

1H-Pyrazolo[3,4-b]pyridin-3-amine
[CAS]

6752-16-5
[Synonyms]

1H-PYRAZOLO[3,4-B]PYRIDIN-3-AMINE
1H-PYRAZOLO[3,4-B]PYRIDIN-3-YLAMINE
3-AMINOPYRAZOLO[3,4-B]PYRIDINE
OTAVA-BB BB7110952567
1H-Pyrazolo[3,4-b]pyridine-3-amine
1H-Pyrazol[3,4]pyridin-3-amine
1H-Pyrazolo[3,4-β]pyridin-3-amine
1H-Pyrazolo[3,4-β]pyridin-3-ylamine
3-Amino-1H-pyrazolo[3,4-β]pyridine
3-Aminopyrazolo[3,4-β]pyridine
NSC 48665
3-Amino-1H-pyrazolo[3,4-b]pyridine
1H-Pyrazolo[3,4-b]pyridin-3-ylamine ,97%
3-Aminopyrazol[3,4-b]pyridine
[Molecular Formula]

C6H6N4
[MDL Number]

MFCD04113611
[Molecular Weight]

134.14
[MOL File]

6752-16-5.mol
Chemical PropertiesBack Directory
[Appearance]

Yellow Solid
[Melting point ]

189-192°C
[Boiling point ]

315.3±25.0 °C(Predicted)
[density ]

1.61±0.1 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[solubility ]

DMSO, Methanol
[form ]

Solid
[pka]

7.17±0.20(Predicted)
[color ]

Yellow
[Detection Methods]

HPLC
[InChI]

1S/C6H6N4/c7-5-4-2-1-3-8-6(4)10-9-5/h1-3H,(H3,7,8,9,10)
[InChIKey]

LUAQTQAFUORQHV-UHFFFAOYSA-N
[SMILES]

Nc1n[nH]c2ncccc12
[CAS DataBase Reference]

6752-16-5(CAS DataBase Reference)
[Storage Precautions]

Store under nitrogen
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H301
[Precautionary statements ]

P301+P310
[Hazard Codes ]

Xi
[Risk Statements ]

25
[Safety Statements ]

45
[RIDADR ]

2811
[WGK Germany ]

1
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[PackingGroup ]

Ⅲ
[HS Code ]

29331990
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethanol-->Sulfuric acid-->Nitric acid-->Palladium-->Zinc chloride-->1,1,3,3-Tetramethoxypropane-->3-Aminopyrazole-->2-Chloro-3-cyanopyridine-->HYDRAZINE
Hazard InformationBack Directory
[Chemical Properties]

Yellow Solid
[Synthesis]

2-Chloro-3-cyanopyridine

6602-54-6

1H-Pyrazolo[3,4-b]pyridin-3-amine

6752-16-5

General procedure for the synthesis of 3-amino-1H-pyrazolo[3,4-b]pyridine from 2-chloro-3-cyanopyridine: 2-chloro-3-cyanopyridine (1.4 mmol) was dissolved in ethanol (10 mL) in a microwave reactor tube, followed by the addition of 5 equivalents of hydrazine hydrate (NH2NH2-H2O). The reaction mixture was placed in a microwave reactor and radiantly heated at 170 °C for 10 min. Upon completion of the reaction, the solvent was removed by rotary evaporator to afford 3-amino-1H-pyrazolo[3,4-b]pyridine in quantitative yield.

[References]

[1] Patent: WO2007/59219, 2007, A1. Location in patent: Page/Page column 56
[2] Chemical Communications, 2014, vol. 50, # 85, p. 12911 - 12914
[3] Canadian Journal of Chemistry, 1988, vol. 66, # 3, p. 420-428
[4] Journal of Heterocyclic Chemistry, 2012, vol. 49, # 4, p. 763 - 767
[5] European Journal of Medicinal Chemistry, 2013, vol. 68, p. 361 - 371
Spectrum DetailBack Directory
[Spectrum Detail]

1H-Pyrazolo[3,4-b]pyridin-3-amine(6752-16-5)1HNMR
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