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Chemical Structure| 99512-64-8 Chemical Structure| 99512-64-8

Structure of 99512-64-8

Chemical Structure| 99512-64-8

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6-Bromo-1,2-dimethyl-1H-benzo[d]imidazole

CAS No.: 99512-64-8

4.5 *For Research Use Only !

Cat. No.: A597400 Purity: 98%

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Product Details of [ 99512-64-8 ]

CAS No. :99512-64-8
Formula : C9H9BrN2
M.W : 225.09
SMILES Code : CC1=NC2=CC=C(Br)C=C2N1C
MDL No. :MFCD16250431

Safety of [ 99512-64-8 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H320-H335
Precautionary Statements:P261-P280-P301+P312-P302+P352-P305+P351+P338

Application In Synthesis of [ 99512-64-8 ]

* 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 [ 99512-64-8 ]

[ 99512-64-8 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 64-19-7 ]
  • [ 337915-79-4 ]
  • [ 99512-64-8 ]
YieldReaction ConditionsOperation in experiment
47% Intermediate XI6-Bromo-1,2-dimethyl-1H-benzoimidazole A solution of 4-bromo-2-methylamino-aniline (1.10 g) in acetic acid (15 mL) was stirred at 130 C. for 2 h. After cooling to ambient temperature, the solution was concentrated under reduced pressure and the residue was taken up in ethyl acetate. The resulting solution was washed with 10% aqueous K2CO3 solution and brine and dried (MgSO4). The solvent was removed and the remainder was purified by chromatography on silica gel (CH2Cl2/MeOH/NH4OH 99:1:0.1->9:1:0.1) to give the title compound as a solid.Yield: 0.58 g (47% of theory); Mass spectrum (ESI+): m/z=225/227 (Br) [M+H]+.
for 2h;Heating / reflux; Part C:A solution of compound 230 (2.50 g, 12.4 mmol) in the corresponding acid (100 ml_) for preparing the compounds in Table 17 was stirred at reflux for 2 hours, at which time LC-MS analysis indicated that the reaction was complete. The reaction mixture was concentrated under vacuum. Purification by column chromatography (SiO2, 5% MeOH / DCM) afforded compounds of general formula 231 as a solid
1.6 g at 118℃; for 3h; j00421j A solution of compound B-74 (1.8 g, 9.0 mmol) in acetic acid (27 mL) was stirred at 118 C for 3 hours, then diluted with water (20 mL) and extracted with ethyl acetate (3 x 60 mL). The combined organic layers were concentrated and purified by silica gel chromatography [petroleum ether: ethyl acetate = 1:0 to 3:11 to give compound B-75 (1.6 g, 77 % yield) as a red solid. LCMS(B): tR=0.291 mm., (ES) mlz (M+H)=225.0.?H-NMR (CD3C1, 400 MHz): 7.54 (d, J=8.4 Hz, 1H), 7.44 (d, J1.2 Hz, 1H), 7.33 (dd, J1=1.6 Hz, J2=2.0 Hz, 1H), 3.71 (s, 3H), 2.60 (s, 3H).
 

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