ChemicalBook--->CAS DataBase List--->1201643-70-0

1201643-70-0

1201643-70-0 Structure

1201643-70-0 Structure
IdentificationBack Directory
[Name]

1-Phenylpyrazole-4-boronic acid
[CAS]

1201643-70-0
[Synonyms]

1-Phenylpyrazole-4-boronic acid
(1-phenylpyrazol-4-yl)boronic acid
1-Phenyl-1H-pyrazole-4-boronic acid
(1-Phenyl-1H-pyrazol-4-yl)boronic acid
Boronic acid, B-(1-phenyl-1H-pyrazol-4-yl)-
[Molecular Formula]

C9H9BN2O2
[MDL Number]

MFCD11044914
[MOL File]

1201643-70-0.mol
[Molecular Weight]

187.99
Chemical PropertiesBack Directory
[Boiling point ]

393.1±34.0 °C(Predicted)
[density ]

1.20±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Store in freezer, under -20°C
[pka]

7.44±0.10(Predicted)
[Appearance]

White to yellow Solid
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P280-P304+P340-P305+P351+P338
[HS Code ]

2933199090
Hazard InformationBack Directory
[Definition]

ChEBI: (1-Phenyl-1H-pyrazol-4-yl)boronic acid is a ring assembly and a member of pyrazoles.
[Synthesis]

1-Phenyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

1002334-12-4

1-Phenylpyrazole-4-boronic acid

1201643-70-0

General procedure for the synthesis of 1-phenyl-1H-pyrazole-4-boronic acid pinacol ester from 1-phenyl-1H-pyrazole-4-boronic acid pinacol ester: To a solution of 1-phenyl-1H-pyrazole-4-boronic acid pinacol ester (0.6 g, 3.1 mmol) in acetone/water (30 mL, v/v = 1:1) was added sodium periodate (NaIO4, 2.0 g, 9.3 mmol) and ammonium acetate (NH4OAc, 0.54 g, 7.1 mmol). The reaction mixture was stirred at room temperature overnight. After completion of the reaction, the mixture was concentrated to give a residue. The residue was purified by column chromatography (eluent: methanol/dichloromethane = 1:5) to afford the target product 1-phenyl-1H-pyrazole-4-boronic acid (0.3 g, 89% yield) as a light yellow solid. Mass spectrometry (MS) analysis showed a molecular ion peak (m/z) of 189 ([M+H]+).

[References]

[1] Patent: WO2009/155527, 2009, A2. Location in patent: Page/Page column 134-135
Spectrum DetailBack Directory
[Spectrum Detail]

1-Phenylpyrazole-4-boronic acid(1201643-70-0)1HNMR
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