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

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

CAS: 1040377-03-4

Molecular Formula: C14H23BN2O3

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1-(Tetrahydro-2H-pyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole - Names and Identifiers

Name 1-(Tetrahydro-2H-pyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
Synonyms 1-(oxan-4-yl)-4
1-(4-Tetrahydropyranyl)-1H-pyrazole-4-boronic acid pinacol ester
1-(Tetrahydro-2H-pyran-4-yl)pyrazole-4-boronic acid pinacol ester
1-(oxan-4-yl)-4-(tetraMethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
1-(Tetrahydropyran-4-yl)-1H-pyrazole-4-boronic acid pinacol ester
1-(Tetrahydro-pyran-4-yl)-1H-pyrazole-4-Boronic acid pinacol ester
1-(Tetrahydropyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
1-(tetrahydro-2H-pyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
1-(Tetrahydro-2H-pyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
3-hydroxy-2,3-dimethylbutan-2-yl hydrogen (1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-4-yl)boronate
CAS 1040377-03-4
InChI InChI=1S/C14H23BN2O3/c1-13(2)14(3,4)20-15(19-13)11-9-16-17(10-11)12-5-7-18-8-6-12/h9-10,12H,5-8H2,1-4H3

1-(Tetrahydro-2H-pyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole - Physico-chemical Properties

Molecular FormulaC14H23BN2O3
Molar Mass278.15
Density1.16
Melting Point113.0 to 117.0 °C
Boling Point413.8±35.0 °C(Predicted)
AppearanceWhite solid
ColorWhite to Light yellow
pKa2.70±0.19(Predicted)
Storage ConditionInert atmosphere,Store in freezer, under -20°C
SensitiveIrritant
MDLMFCD12033229

1-(Tetrahydro-2H-pyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole - Reference Information

Use 1-(tetrahydropyran-4-yl)-1H-pyrazol-4-borate pinacol ester is a 1-Substituted-1H-pyrazol-4-borate pinacol ester. 1-substituted-1H-pyrazol-4-borate pinacol ester is a kind of relatively novel compounds and important pharmaceutical intermediates, which has a wide range of application prospects, such as crizotinib intermediate 1-(1-tert-butoxycarbonylpiperidine-4-yl) pyrazol-4-borate pinacol ester.
preparation step 1: synthesis of compound tetrahydro-2H-pyran-4-methylsulfonate add TEA(9mL,63.9mmol) to methylene chloride (60mL) solution of tetrahydropyran-4-ol (4mL,41.11mmol) at 0 ℃, stir for 5min and slowly add methyl sulfonyl chloride (3.5mL,45mmol), after continuing the reaction for 1h, the room temperature reaction was restored overnight. Water (50mL) was added to the reaction solution, methylene chloride (100mL × 3) was extracted, and the organic phase was dried with anhydrous Na2SO4 and concentrated to obtain 7g yellow solid with a yield of 94.5%. MS(ESI,pos.ion)m/z: no response. Step 2: Synthesis of Compound 1-(Tetrahydropyran -4-yl)-1H-pyrazole -4-borate pinacol ester; Tetrahydro-2H-pyran -4-methylsulfonate ester (2.8g,16mmol), 4-pyrazole borate pinacol ester (2.01g,10.4mmol) and cesium carbonate (5.4g,17mmol) were mixed and DMF(30mL) was added to react overnight at 100 ℃. The reaction solution was concentrated under reduced pressure to remove DMF, water (20mL) was added, methylene chloride (30mL × 3) was extracted, the organic phase was dried with anhydrous Na2SO4, and the concentrated crude product was prepared, separated and purified by HPLC to obtain 1.1g yellow oil with a yield of 38%. MS(ESI,pos.ion)m/z:279.3[M 1].
Last Update:2024-04-10 22:30:50
1-(Tetrahydro-2H-pyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
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SHANGHAI ACMEC BIOCHEMICAL TECHNOLOGY CO., LTD.
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Product Name: 1-(Tetrahydro-2H-pyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole Visit Supplier Webpage Request for quotation
CAS: 1040377-03-4
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Mobile: +86-18621343501
QQ: 2881950922 Click to send a QQ message
Wechat: 18621343501
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Shanghai Macklin Biochemical Co., Ltd
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Product Name: 1-(Tetrahydro-2H-pyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole Visit Supplier Webpage Request for quotation
CAS: 1040377-03-4
Tel: +86-18821248368
Email: Int06@meryer.com
Mobile: +86-18821248368
QQ: 495145328 Click to send a QQ message
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Shanghai Yuanye Bio-Technology Co., Ltd.
Spot supply
Product Name: 1-(Tetrahydro-2H-pyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole Visit Supplier Webpage Request for quotation
CAS: 1040377-03-4
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View History
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