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84407-13-6

84407-13-6 Structure

84407-13-6 Structure
IdentificationBack Directory
[Name]

2-(4-Amino-1H-pyrazol-1-yl)ethanol
[CAS]

84407-13-6
[Synonyms]

2-(3-Amino-1H-pyrazol-1-yl)
2-(3-AMINOPYRAZOL-1-YL)ETHANOL
1H-Pyrazole-1-ethanol, 3-aMino-
2-(3-AMino-1H-pyrazol-1-yl)ethanol
2-(4-Amino-1H-pyrazol-1-yl)ethanol
2-(3-amino-1H-pyrazol-1-yl)ethan-1-ol
2-(4-Amino-1H-pyrazol-1-yl)ethanol (Related Reference)
[Molecular Formula]

C5H9N3O
[MDL Number]

MFCD12149344
[MOL File]

84407-13-6.mol
[Molecular Weight]

127.14
Chemical PropertiesBack Directory
[Boiling point ]

337.9±22.0 °C(Predicted)
[density ]

1.35±0.1 g/cm3(Predicted)
[storage temp. ]

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

14.42±0.10(Predicted)
[Appearance]

Colorless to off-white Solid
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H332-H335
[Precautionary statements ]

P261-P280-P305+P351+P338
Hazard InformationBack Directory
[Uses]

2-(3-Amino-1H-pyrazol-1-yl)ethanol is a reagent in the preparation of pyrazolo pyrimidines with CK2 kinase inhibitory activity.
[Synthesis]

2-(3-nitro-1H-pyrazol-1-yl)ethanol

956951-01-2

2-(4-Amino-1H-pyrazol-1-yl)ethanol

84407-13-6

General procedure for the synthesis of 2-(4-amino-1H-pyrazol-1-yl)ethanol from 3-nitro-1H-pyrazol-1-ethanol: 2-(3-nitro-1H-pyrazol-1-yl)ethanol (0.187 g, 1.19 mmol) was dissolved in ethanol (6 mL) and 10% palladium/carbon catalyst (20 mg) was added under argon protection. The reaction mixture was stirred overnight at room temperature and under hydrogen atmosphere (using a hydrogen balloon). Upon completion of the reaction, the insoluble material was removed by filtration through a diatomaceous earth pad and washed with ethanol. The filtrate and washings were combined and concentrated under reduced pressure to remove the solvent to give the target product 2-(4-amino-1H-pyrazol-1-yl)ethanol (light brown tar-like substance, 0.151 g, 1.18 mmol, 99% yield).

[References]

[1] Patent: JP5829520, 2015, B2. Location in patent: Paragraph 0469
[2] Patent: WO2016/180843, 2016, A1. Location in patent: Page/Page column 43
[3] Patent: WO2008/156757, 2008, A1. Location in patent: Page/Page column 234
[4] Patent: US2012/283271, 2012, A1. Location in patent: Page/Page column 11
[5] Patent: WO2013/17479, 2013, A1. Location in patent: Page/Page column 43-44
Spectrum DetailBack Directory
[Spectrum Detail]

2-(4-Amino-1H-pyrazol-1-yl)ethanol(84407-13-6)1HNMR
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