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2-(1H-Pyrazol-4-yl)-ethanol

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2-(1H-Pyrazol-4-yl)-ethanol manufacturers

2-(1H-Pyrazol-4-yl)-ethanol Basic information
Product Name:2-(1H-Pyrazol-4-yl)-ethanol
Synonyms:4-(2-Hydroxyethyl)-1H-pyrazole 98%;1H-PYRAZOLE-4-ETHANOL;2-(1H-Pyrazol-4-yl)ethan-1-ol, 1-Hydroxy-2-(1H-pyrazol-4-yl)ethane;4-(2-Hydroxyethyl)-1H-pyrazole;2-(1H-Pyrazol-4-yl)-ethanol, 97%+;AKOS B018513;ART-CHEM-BB B018513;CHEMBRDG-BB 4000128
CAS:180207-57-2
MF:C5H8N2O
MW:112.13
EINECS:
Product Categories:Pyrazole
Mol File:180207-57-2.mol
2-(1H-Pyrazol-4-yl)-ethanol Structure
2-(1H-Pyrazol-4-yl)-ethanol Chemical Properties
Melting point 54-55 °C
Boiling point 140-145 °C(Press: 0.3 Torr)
density 1.228±0.06 g/cm3(Predicted)
storage temp. under inert gas (nitrogen or Argon) at 2-8°C
form solid
pka14.34±0.50(Predicted)
color Yellow
InChIInChI=1S/C5H8N2O/c8-2-1-5-3-6-7-4-5/h3-4,8H,1-2H2,(H,6,7)
InChIKeyYVQFZSHMTCZYMI-UHFFFAOYSA-N
SMILESN1C=C(CCO)C=N1
Safety Information
Hazard Codes Xi
HazardClass IRRITANT
HS Code 2933199090
MSDS Information
2-(1H-Pyrazol-4-yl)-ethanol Usage And Synthesis
Synthesis
Furan, 3-(diethoxymethyl)-2-ethoxytetrahydro- (9CI)

177940-20-4

2-(1H-PYRAZOL-4-YL)-ETHANOL

180207-57-2

General procedure for the synthesis of 2-(1H-pyrazol-4-yl)ethanol from 3-(diethoxymethyl)-2-ethoxytetrahydrofuran: To intermediate 47A (30.00 g, 137.00 mmol) was slowly added hydrazine dihydrochloride (18.75 g, 179.00 mmol) dissolved in a mixture of water (50 mL) and ethanol (25 mL) at 0 °C. solution. The reaction mixture was stirred at 0°C for 1 hour and then continued to stir at room temperature for 1 hour. Sodium carbonate (30.00 g) was added to the reaction mixture and then evaporated to dryness under reduced pressure. The residue was washed with ethanol (10 mL) and evaporated again to give Intermediate 47B (15.00 g, 92% yield) as a brown oil. The product was analyzed by 'HNMR (400 MHz, CDCI3) with chemical shifts of 6 ppm 2.78 (t, J=6.38 Hz, 2H), 3.72 (d, J=7.25 Hz, 1H), 3.77-3.88 (m, 2H), 7.49 (s, 2H), and 9.52-10.74 (m, 1H).The LCMS analysis (Method-i) showed a retention time of 0.40 min and [M-H]- peak of 113.0.

References[1] Patent: WO2018/93569, 2018, A1. Location in patent: Page/Page column 134
[2] Journal of the American Chemical Society, 1953, vol. 75, p. 4048,4050
2-(1H-Pyrazol-4-yl)-ethanol Preparation Products And Raw materials
Raw materialsFuran, 3-(diethoxymethyl)-2-ethoxytetrahydro- (9CI)-->Water-->Ethanol-->Hydrazine dihydrochloride
Preparation Products2-(1H-Pyrazol-4-yl)-ethylamine
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