1029439-49-3|2-(4-(Bromomethyl)-2-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane| Ambeed

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Quality Control of [ 1029439-49-3 ] Purity: 96% SDS Specification

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Product Details of [ 1029439-49-3 ]

CAS No. :	1029439-49-3
Formula :	C₁₃H₁₇BBrFO₂
M.W :	314.99
SMILES Code :	CC1(C)C(C)(C)OB(C2=CC=C(CBr)C=C2F)O1
MDL No. :	MFCD18434471
InChI Key :	QOCYLABQSVWXGE-UHFFFAOYSA-N
Pubchem ID :	53217331

Safety of [ 1029439-49-3 ]

GHS Pictogram:
Signal Word:	Danger
Hazard Statements:	H302-H314
Precautionary Statements:	P260-P264-P270-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P405-P501
Class:	8
UN#:	3261
Packing Group:	Ⅱ

Application In Synthesis of [ 1029439-49-3 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

Downstream synthetic route of [ 1029439-49-3 ]

[ 1029439-49-3 ] Synthesis Path-Downstream 1~1

1
[ 1029439-49-3 ]
[ 939-69-5 ]
6-((3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)oxy)benzo[d]thiazole-2-carbonitrile [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
69%	With cesium chloride; In N,N-dimethyl-formamide; at 60℃;	Example 2B: 6-(3-fluoro-4-(4, 4, 5, 5-tetramethyl-1 , 3, 2-dioxaborolan-2- yl)benzyloxy)benzo[d]thiazole-2-carbonitrile[0087] Example 2A (356.0 mg, 1 .13 mmol) and <strong>[939-69-5]2-cyano-6-hydroxybenzothiazole</strong> (200.4 mg, 1 .13 mmol) were dissolved in 20 ml. dry DMF prior to the addition of cesium chloride (406.4 mg, 1 .25 mmol). The mixture was stirred at 60°C for 45-50 minutes before it was allowed to cool to room temperature. 50 ml. ethyl acetate was added to the reaction, and the organic phase was washed three times with deionized water. The aqueous layers were combined and washed three times with ethyl acetate. All of the organic layers were combined, washed twice with brine, dried over sodium sulfate, and concentrated. The crude material was purified on a silica column (90: 10 hexanes:ethyl acetate, dry loaded) to give 320 mg (69 percent) of the pure product.1H NM R (CDCI3): delta 1 .37 (s, 12H), 5.19 (s, 2H), 7.14 (d, J = 9.9 Hz, 1 H), 7.21 (d, J = 7.7 Hz, 1 H), 7.31 (dd, J = 9.1 Hz, 2.5 Hz, 1 H), 7.37 (d, J = 2.4 Hz, 1 H), 7.78 (t, J = 7.3 Hz, 1 H), 8.10 (d, J = 9.1 Hz, 1 H).

References: [1]Patent: WO2014/127360,2014,A1 .Location in patent: Paragraph 87.

Historical Records

Technical Information

• Alkyl Halide Occurrence • General Reactivity • Grignard Reaction • Hiyama Cross-Coupling Reaction • Kinetics of Alkyl Halides • Kumada Cross-Coupling Reaction • Reactions of Alkyl Halides with Reducing Metals • Reactions of Amines • Reactions of Benzene and Substituted Benzenes • Reactions of Dihalides • Stille Coupling • Substitution and Elimination Reactions of Alkyl Halides • Suzuki Coupling

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[ 1029439-49-3 ]

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CAS No.: 1029439-49-3

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