76041-86-6|2-Bromo-N,N-diethylbenzamide| Ambeed

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Quality Control of [ 76041-86-6 ] Purity: 97% SDS Specification

COA

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NMR

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CNMR

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HPLC

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Product Details of [ 76041-86-6 ]

CAS No. :	76041-86-6
Formula :	C₁₁H₁₄BrNO
M.W :	256.14
SMILES Code :	CCN(CC)C(=O)C1=C(Br)C=CC=C1
MDL No. :	MFCD00457139
InChI Key :	BYMBWCOGISFGJL-UHFFFAOYSA-N
Pubchem ID :	669044

Safety of [ 76041-86-6 ]

GHS Pictogram:
Signal Word:	Warning
Hazard Statements:	H315-H319
Precautionary Statements:	P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362

Application In Synthesis of [ 76041-86-6 ]

* 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 [ 76041-86-6 ]

[ 76041-86-6 ] Synthesis Path-Downstream 1~35

1
[ 7154-66-7 ]
[ 109-89-7 ]
[ 76041-86-6 ]

Yield	Reaction Conditions	Operation in experiment
95%	In dichloromethane; at 0 - 20℃; for 0.5h;	To a mixture of 2-bromo benzoylchloride (3.5 g, 16 mmol) in CH2Cl2 (50 mL) at 0C was added diethylamine (3.2 mL, 32 mmol) drop-wise and the resulting mixture was allowed to obtain room temperature. After 30 minutes, water was added, the mixture was diluted with CH2C12, washed with saturated aqueous NaHCO3-solution and saturated aqueous NH4Cl-solution, dried (Na2S04) and concentrated to give 3.9 g (95%) of the title compound (189JO10). lH NM : R (CDC13) 6 7.54 (m, 1 H), 7.32 (m, 1 H), 7.22 (m, 2 H), 3.79 (m, 1 H), 3.33 (m, 1 H), 3.13 (m, 2 H), 1.26 (t, 3 H, J= 7.2 Hz), 1. 05 (t, 3 H, J= 7.0 Hz). 13C NMR (CDC13) b 168.5, 139.0, 132.8, 130.0, 127.61, 127.59, 119.3, 42.8, 39.0, 14.0, 12.6
95%	In dichloromethane; at 0 - 20℃; for 0.5h;	To a mixture of 2-bromo benzoylchloride (3.5 g, 16 mmol) in CH2CI2 (50 mL) at 00C was added diethylamine (3.2 mL, 32 mmol) drop-wise and the resulting mixture was allowed to obtain room temperature. After 30 minutes, water was added, the mixture was diluted with CH2Cl2, washed with saturated aqueous NaHCO3-solution and saturated aqueous NHtCl-solution, dried (Na2SO-O and concentrated to give 3.9 g (95%) of the title compound (189JO 10). 1H NMR (CDCl3) δ 7.54 (m, 1 H), 7.32 (m, 1 H), 7.22 (m, 2 H), 3.79 (m, 1 H), 3.33 (m, 1 H), 3.13 (m, 2 H), 1.26 (t, 3 H, J = 7.2 Hz), 1.05 (t, 3 H, J= 7.0 Hz). 13C NMR (CDCl3) δ 168.5, 139.0, 132.8, 130.0, 127.61, 127.59, 119.3, 42.8, 39.0, 14.0, 12.6
95%	In dichloromethane; at 0 - 20℃; for 0.5h;	To a mixture of 2-bromo benzoylchloride (3.5 g, 16 mmol) in CH2Cl2 (50 mL) at O0C was added diethylamine (3.2 mL, 32 mmol) drop-wise and the resulting mixture was allowed to obtain room temperature. After 30 minutes, water was added, the mixture was diluted with CH2Cl2, washed with saturated aqueous NaHCO3-solution and saturated aqueous NH4Cl-solution, dried (Na2SO4) and concentrated to give 3.9 g (95%) of the title compound (189JO10). 1R NMR (CDCl3) δ 7.54 (m, 1 H), 7.32 (m, 1 H), 7.22 (m, 2 H), 3.79 (m, 1 H), 3.33 (m, 1 H), 3.13 (m, 2 H), 1.26 (t, 3 H, J = 7.2 Hz), 1.05 (t, 3 H3 J= 7.0 Hz). 13C NMR (CDCl3) δ 168.5, 139.0, 132.8, 130.0, 127.61, 127.59, 119.3, 42.8, 39.0, 14.0, 12.6

In dichloromethane; at 0℃; for 0.5h;

To a solution of 2-bromobenzoyl chloride (5.36 mL, 41.01 mmol) in CH2Cl2 (57 mL) at 0 C., was added diethylamine dropwise. The reaction mixture stirred at 0 C. for approximately thirty minutes before it was diluted with CH2Cl2 (100 mL) and washed with water, aqueous 5% NaHCO3, and brine. The organic phase was dried over sodium sulfate, filtered, and concentrated to give 2-bromo-N,N-diethylbenzamide, 30, which was used without further purification. LCMS (ES) m/z 256.1 (M+H)+.

References: [1]Chemistry - A European Journal,2020,vol. 26,p. 6608 - 6621.
[2]Organic Letters,2013,vol. 15,p. 5986 - 5989.
[3]Patent: WO2005/63254,2005,A2 .Location in patent: Page/Page column 90.
[4]Patent: WO2008/21463,2008,A2 .Location in patent: Page/Page column 93.
[5]Patent: WO2006/107948,2006,A2 .Location in patent: Page/Page column 110.
[6]Journal of Organic Chemistry,1954,vol. 19,p. 493,496.
[7]Polish Journal of Chemistry,1983,vol. 57,p. 429 - 434.
[8]Patent: US2005/261327,2005,A1 .Location in patent: Page/Page column 17; 26.
[9]Journal of Organic Chemistry,2008,vol. 73,p. 9710 - 9719.

2
[ 1696-17-9 ]
[ 76041-86-6 ]

References: [1]Tetrahedron,1992,vol. 48,p. 4863 - 4878.

3
[ 1696-17-9 ]
[ 76041-86-6 ]
[ 85370-72-5 ]

References: [1]Journal of Organic Chemistry,1988,vol. 53,p. 2728 - 2732.
[2]Journal of Organic Chemistry,1988,vol. 53,p. 2728 - 2732.

4
[ 76041-86-6 ]
[ 103681-98-7 ]
[ 103681-93-2 ]

References: [1]Tetrahedron Letters,1985,vol. 26,p. 5997 - 6000.

5
[ 76041-86-6 ]
[ 115237-67-7 ]
Diethyl-carbamic acid 2-diethylcarbamoyl-2''-methoxymethoxy-[1,3';1',1'';3'',1''']quaterphenyl-2'-yl ester [ No CAS ]

References: [1]Tetrahedron Letters,1987,vol. 28,p. 5097 - 5098.

6
[ 76041-86-6 ]
[ 91428-19-2 ]

References: [1]Synthesis,1980,p. 695 - 697.

7
[ 76041-86-6 ]
[ 3034-28-4 ]

References: [1]Journal of Organic Chemistry,1984,vol. 49,p. 737 - 742.

8
[ 76041-86-6 ]
[ 4892-02-8 ]
[ 123251-40-1 ]

References: [1]Chemical and Pharmaceutical Bulletin,1989,vol. 37,p. 36 - 41.

9
[ 1696-17-9 ]
[ 76041-86-6 ]
[ 88440-83-9 ]

References: [1]Tetrahedron Letters,1995,vol. 36,p. 1039 - 1042.

10
[ 100-39-0 ]
[ 76041-86-6 ]
[ 103-29-7 ]
N,N-diethyl-2-(phenylmethyl)benzamide [ No CAS ]

References: [1]Tetrahedron Letters,1995,vol. 36,p. 1039 - 1042.

11
[ 76041-86-6 ]
[ 109-94-4 ]
[ 77420-44-1 ]

References: [1]Journal of Organic Chemistry,1986,vol. 51,p. 3325 - 3334.

12
[ 76041-86-6 ]
[ 536-90-3 ]
[ 207802-65-1 ]

References: [1]Synlett,1998,p. 419 - 421.
[2]Journal of Organic Chemistry,2008,vol. 73,p. 9710 - 9719.

13
[ 76041-86-6 ]
[ 134-32-7 ]
[ 207802-70-8 ]

References: [1]Synlett,1998,p. 419 - 421.
[2]Journal of Organic Chemistry,2008,vol. 73,p. 9710 - 9719.

14
[ 76041-86-6 ]
[ 62-53-3 ]
[ 207802-64-0 ]

References: [1]Synlett,1998,p. 419 - 421.
[2]Journal of Organic Chemistry,2008,vol. 73,p. 9710 - 9719.

15
[ 76041-86-6 ]
[ 10272-07-8 ]
[ 207802-68-4 ]

References: [1]Synlett,1998,p. 419 - 421.
[2]Journal of Organic Chemistry,2008,vol. 73,p. 9710 - 9719.

16
[ 17715-69-4 ]
[ 76041-86-6 ]
[ 213479-73-3 ]

References: [1]Synthesis,1998,p. 1195 - 1198.

17
[ 60319-09-7 ]
[ 76041-86-6 ]
[ 213479-71-1 ]

References: [1]Synthesis,1998,p. 1195 - 1198.

18
[ 2859-78-1 ]
[ 76041-86-6 ]
[ 213479-70-0 ]

References: [1]Synthesis,1998,p. 1195 - 1198.

19
[ 25245-34-5 ]
[ 76041-86-6 ]
[ 213479-72-2 ]

References: [1]Synthesis,1998,p. 1195 - 1198.

20
[ 76041-86-6 ]
[ 213479-69-7 ]
[ 213479-74-4 ]

References: [1]Synthesis,1998,p. 1195 - 1198.

21
[ 76041-86-6 ]
[ 108-39-4 ]
[ 1696-17-9 ]
N,N-diethyl-2-m-tolyloxy-benzamide [ No CAS ]

References: [1]Journal of Organic Chemistry,1999,vol. 64,p. 2986 - 2987.

22
[ 76041-86-6 ]
[ 95-53-4 ]
[ 1027035-99-9 ]

References: [1]Tetrahedron Letters,2001,vol. 42,p. 385 - 389.
[2]Journal of Organic Chemistry,2008,vol. 73,p. 9710 - 9719.

23
[ 76041-86-6 ]
[ 123-38-6 ]
lithium dibutyl(isopropyl)magnesate [ No CAS ]
N,N-diethyl-2-(1-hydroxypropyl)benzamide [ No CAS ]

References: [1]Journal of Organic Chemistry,2001,vol. 66,p. 4333 - 4339.

24
[ 76041-86-6 ]
[ 106-95-6 ]
lithium dibutyl(isopropyl)magnesate [ No CAS ]
[ 88440-83-9 ]

References: [1]Journal of Organic Chemistry,2001,vol. 66,p. 4333 - 4339.

25
[ 62924-92-9 ]
[ 76041-86-6 ]

References: [1]Organic Letters,2005,vol. 7,p. 2523 - 2526.

26
[ 40244-90-4 ]
[ 76041-86-6 ]
[2-(diethylaminocarbonyl)phenyl]diisopropylphosphine [ No CAS ]

References: [1]Russian Journal of General Chemistry,2005,vol. 75,p. 1060 - 1068.

27
[ 60054-87-7 ]
[ 76041-86-6 ]
2-(tert-butyl-isopropyl-phosphanyl)-N,N-diethyl-benzamide [ No CAS ]

References: [1]Russian Journal of General Chemistry,2005,vol. 75,p. 1060 - 1068.

28
[ 932382-19-9 ]
[ 76041-86-6 ]
3-(2-diethylcarbamoyl-phenyl)-N,N-diethyl-isonicotinamide [ No CAS ]

References: [1]Journal of Organic Chemistry,2007,vol. 72,p. 1588 - 1594.

29
[ 76041-86-6 ]
[ 28721-07-5 ]

References: [1]Tetrahedron Letters,2001,vol. 42,p. 385 - 389.
[2]Tetrahedron Letters,2001,vol. 42,p. 385 - 389.
[3]Tetrahedron Letters,2001,vol. 42,p. 385 - 389.
[4]Tetrahedron Letters,2001,vol. 42,p. 385 - 389.

30
[ 76041-86-6 ]
[ 21737-58-6 ]

References: [1]Tetrahedron Letters,2001,vol. 42,p. 385 - 389.
[2]Tetrahedron Letters,2001,vol. 42,p. 385 - 389.
[3]Tetrahedron Letters,2001,vol. 42,p. 385 - 389.

31
[ 76041-86-6 ]
[ 4698-11-7 ]