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Chemical Structure| 10445-91-7 Chemical Structure| 10445-91-7

Structure of 10445-91-7

Chemical Structure| 10445-91-7

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Product Details of [ 10445-91-7 ]

CAS No. :10445-91-7
Formula : C6H6ClN
M.W : 127.57
SMILES Code : ClCC1=CC=NC=C1
MDL No. :MFCD03465807

Safety of [ 10445-91-7 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Application In Synthesis of [ 10445-91-7 ]

* 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 [ 10445-91-7 ]

[ 10445-91-7 ] Synthesis Path-Downstream   1~3

  • 1
  • [ 10445-91-7 ]
  • [ 50-00-0 ]
  • [ 5344-27-4 ]
YieldReaction ConditionsOperation in experiment
71% General procedure: Phenethyl alcohol (3a) A two neck Schlenk flask equipped with a magnetic stirring bar and septum was heated with heat gun (~400 C) for 10 min under high vacuum. After cooling to room temperature, the flask was flushed with argon (3 times). Zn-dust (654 mg, 2.0 equiv, 10.0 mmol) was added followed by THF (20 mL). 1,2-Dibromoethane (5 mol%) was added and the reaction mixture was heated until ebullition occurs. After cooling to rt, chlorotrimethylsilane (1 mol%) was added and the mixture was heated again till ebullition occurs. The flask was again cooled to rt and benzyl chloride (633 mg, 5.0 mmol, 1 equiv) was added as a solution in THF (10 mL) and it was heated at 70 C for 2 h and cooled to rt. Paraformaldehyde (450 mg, 3.0 equiv. 15.0 mmol) was slowly added at rt and the flask was again heated at 70 C for 6 h. The solution was cooled to rt and saturated NH4Cl solution was added. The phases were separated and the aqueous layer was extracted with ethyl acetate (100 mL). The combined organic layer was washed with water (20 mL), brine (10 mL) and then dried over Na2SO4. The solvents were evaporated under reduced pressure and the residue was purified by silica gel column chromatography using cyclohexane or cyclohexane/ethyl acetate as an eluent to obtain phenethyl alcohol (3a) (510 mg, 83%) as a colourless liquid.
  • 2
  • [ 10445-91-7 ]
  • [ 56293-29-9 ]
  • 12-N-(pyridine-4-methyl)aloperine hydrochloride [ No CAS ]
YieldReaction ConditionsOperation in experiment
78% With potassium iodide; In acetonitrile; at 20℃; General procedure: Take <strong>[56293-29-9]aloperine</strong> (1) 0.5 g (0,002 mol),Was added to 20 ml of acetonitrile, and 1.8 g (0.006 mol) of anhydrous potassium carbonate and substituted bromobenzyl or benzyl chloride (0.003 mol) were successively added to the reaction solution, followed by stirring at room temperature.TLC was detected until the reaction was complete. The organic phase was concentrated and evaporated to dryness. The solvent was dissolved in dichloromethane and washed successively with water and saturated brine. The methylene chloride layer was dried and the solvent was evaporated to dryness with a rotary evaporator to give the crude 12-N-benzyl <strong>[56293-29-9]aloperine</strong> derivative. The solution was dissolved in 20 ml of methylene chloride solventAnd then separated by column chromatography to give pure product of 12-N-benzyl-<strong>[56293-29-9]aloperine</strong> derivative (2). The resulting compound was dissolved in 5 ml of ether,And then with 1N HCl / Et2O adjusted PH = 6-7, filtered, 12-N-benzyl ether alkalis derivatives pure hydrochloric acid.
  • 3
  • [ 10445-91-7 ]
  • [ 212141-54-3 ]
 

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