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[ CAS No. 1310048-95-3 ]

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Chemical Structure| 1310048-95-3
Chemical Structure| 1310048-95-3
Structure of 1310048-95-3 * Storage: {[proInfo.prStorage]}

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Product Details of [ 1310048-95-3 ]

CAS No. :1310048-95-3 MDL No. :MFCD10698518
Formula : C13H18BFO2 Boiling Point : -
Linear Structure Formula :- InChI Key :N/A
M.W :236.09 g/mol Pubchem ID :-
Synonyms :

Safety of [ 1310048-95-3 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501 UN#:N/A
Hazard Statements:H302-H315-H319-H335 Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 1310048-95-3 ]

  • Downstream synthetic route of [ 1310048-95-3 ]

[ 1310048-95-3 ] Synthesis Path-Downstream   1~3

  • 1
  • [ 57606-65-2 ]
  • [ 78782-17-9 ]
  • [ 1310048-95-3 ]
YieldReaction ConditionsOperation in experiment
72% With tetra(n-butyl)ammonium hydroxide; palladium diacetate; triphenylphosphine In 1,4-dioxane; water at 20℃; Inert atmosphere;
  • 2
  • [ 18680-27-8 ]
  • [ 1310048-95-3 ]
  • (3aS,4S,6S,7aR)-2-(3-fluorobenzyl)-5,5,7a-trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborole [ No CAS ]
YieldReaction ConditionsOperation in experiment
98% In diethyl ether at 20℃; for 24h; Inert atmosphere; Schlenk technique;
  • 3
  • [ 56181-39-6 ]
  • [ 1310048-95-3 ]
  • 4-chloro-5-[(3-fluorophenyl)methyl]pyrimidine [ No CAS ]
YieldReaction ConditionsOperation in experiment
With potassium carbonate 90.a.E E) E) 4-chloro-5-[(3-fluorophenyl)methyl]pyrimidine To a mixture of 5-bromo-4-chloro-pyrimidine (300 mg), 2-[(3-fluorophenyl)methyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (785 mg), dioxane (10 mL) and water (0.5 mL) were added Pd(dppf)Cl2 (113 mg) and potassium carbonate (472 mg) at room temperature. The mixture was stirred under nitrogen atmosphere at 85° C. for 12 hr. The reaction solution was filtered through Celite, and the filtrate was concentrated. The residue was purified by preparative TLC (petroleum ether/ethyl acetate=3/1) to give the title compound (140 mg). MS: [M+H]+ 223.6.
140 mg With palladium (II) [1,1'-bis(diphenylphosphanyl)ferrocene] dichloride; potassium carbonate In 1,4-dioxane; water monomer at 85℃; for 12h; Inert atmosphere; 90.a.E E) 4-chloro-5-[(3-fluorophenyl)methyl]pyrimidine To a mixture of 5-bromo-4-chloro-pyrimidine (300 mg), 2-[(3-fluorophenyl)methyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (785 mg), dioxane (10 mL) and water (0.5 mL) were added Pd(dppf)Cl2 (113 mg) and potassium carbonate (472 mg) at room temperature. The mixture was stirred under nitrogen atmosphere at 85° C. for 12 hr. The reaction solution was filtered through Celite, and the filtrate was concentrated. The residue was purified by preparative TLC (petroleum ether/ethyl acetate=3/1) to give the title compound (140 mg). MS: [M+H]+ 223.6.
140 mg With palladium (II) [1,1'-bis(diphenylphosphanyl)ferrocene] dichloride; potassium carbonate In 1,4-dioxane; water monomer at 85℃; for 12h; Inert atmosphere; 90.a.E E) 4-chloro-5-[(3-fluorophenyl)methyl]pyrimidine To a mixture of 5-bromo-4-chloro-pyrimidine (300 mg), 2-[(3-fluorophenyl)methyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (785 mg), dioxane (10 mL) and water (0.5 mL) were added Pd(dppf)Cl2 (113 mg) and potassium carbonate (472 mg) at room temperature. The mixture was stirred under nitrogen atmosphere at 85° C. for 12 hr. The reaction solution was filtered through Celite, and the filtrate was concentrated. The residue was purified by preparative TLC (petroleum ether/ethyl acetate=3/1) to give the title compound (140 mg). MS: [M+H]+ 223.6.
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