[ CAS No. 1315350-04-9 ]

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2D3D

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Quality Control of [ 1315350-04-9 ]

COA NMR CNMR HPLC LC-MS

Related Doc. of [ 1315350-04-9 ]

SDS

Alternatived Products of [ 1315350-04-9 ]

Product Details of [ 1315350-04-9 ]

CAS No. :	1315350-04-9	MDL No. :
Formula :	C₁₃H₁₇BN₂O₂	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	-
M.W :	244.10	Pubchem ID :	-
Synonyms :

Computed Properties of [ 1315350-04-9 ]

TPSA :Topological Polar Surface Area	-	H-Bond Acceptor Count :	-
XLogP3 :	-	H-Bond Donor Count :	-
SP3 :	-	Rotatable Bond Count :	-

Safety of [ 1315350-04-9 ]

Signal Word:	Warning	Class:
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#:
Hazard Statements:	H302-H312-H315-H319-H332-H335	Packing Group:
GHS Pictogram:

Application In Synthesis of [ 1315350-04-9 ]

Downstream synthetic route of [ 1315350-04-9 ]

[ 1315350-04-9 ] Synthesis Path-Downstream 1~1

1
[ 1315350-04-9 ]
[ 57486-69-8 ]
[ 1434044-06-0 ]

Yield	Reaction Conditions	Operation in experiment
89%		General procedure: To a 2-5 mL capacity microwave vial was charged <strong>[57486-69-8]methyl 2-(2-bromophenyl)acetate</strong> (0.100g, 0.43 mmol), 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline (0.115 g, 0.523 mmol)and cesium carbonate (0.280 g, 0.86 mmol) in anhydrous 1,2-dimethoxy ethane (4 mL). Themixture was stirred and degassed with argon for 5 min. To this mixture was added Pd(PPh3)4(25 mg, 0.021 mmol) under argon atmosphere, and purged for 2 min. The tube was sealedand irradiated in microwave at 125 C for 0.5 h (This is the internal temperature of reactionmixture and monitored on the screen through a sensor). The vial was cooled to 0C over aperiod of 15 min, followed by addition of 1M potassium tert-butoxide (0.65 mL, 0.65 mmol)solution in THF. The resulting mixture was stirred for 10 minutes and quenched withsaturated ammonium chloride solution. The mixture was diluted with ethyl acetate (30 mL)and washed with water and brine. The organic layer was dried over anhydrous sodiumsulfate, filtered and concentrated. The residue obtained was purified by flash columnchromatography by eluting with gradient of 2-20% ethyl acetate in hexane to afford the 5Hdibenzo[b,d]azepin-6(7H)-one (4) as off white solid (0.075 g, 82%).

Reference： [1]Tetrahedron Letters,2013,vol. 54,p. 2916 - 2919

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[ 1315350-04-9 ]

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P304 + P340	IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P304 + P341	IF INHALED: If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing.
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P337 + P313	IF eye irritation persists: Get medical advice/attention.
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Physical hazards
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H200	Unstable explosive
H201	Explosive; mass explosion hazard
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Code	Phrase
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H402	Harmful to aquatic life
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H411	Toxic to aquatic life with long-lasting effects
H412	Harmful to aquatic life with long-lasting effects
H413	May cause long-lasting harmful effects to aquatic life
H420	Harms public health and the environment by destroying ozone in the upper atmosphere

[ CAS No. 1315350-04-9 ]

Quality Control of [ 1315350-04-9 ]

Related Doc. of [ 1315350-04-9 ]

Product Details of [ 1315350-04-9 ]

Computed Properties of [ 1315350-04-9 ]

Safety of [ 1315350-04-9 ]

Application In Synthesis of [ 1315350-04-9 ]

[ 1315350-04-9 ] Synthesis Path-Downstream 1~1

Related Functional Groups of [ 1315350-04-9 ]

Nitriles

Organoboron

Amines

Aryls

Organoboron

Esters

Precautionary Statements-General

Prevention

Response

Storage

Disposal

Physical hazards

Health hazards

Environmental hazards

Inquiry

Related Functional Groups of
[ 1315350-04-9 ]