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Chemical Structure| 527-60-6 Chemical Structure| 527-60-6
Chemical Structure| 527-60-6

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Product Details of 2,4,6-Trimethylphenol

CAS No. :527-60-6
Formula : C9H12O
M.W : 136.19
SMILES Code : OC1=C(C)C=C(C)C=C1C
MDL No. :MFCD00002235
InChI Key :BPRYUXCVCCNUFE-UHFFFAOYSA-N
Pubchem ID :10698

Safety of 2,4,6-Trimethylphenol

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H315-H318-H335-H373-H411
Precautionary Statements:P260-P264-P271-P273-P280-P302+P352-P304+P340+P312-P305+P351+P338+P310-P314-P332+P313-P391-P403+P233-P405-P501
Class:9
UN#:3077
Packing Group:

Application In Synthesis of 2,4,6-Trimethylphenol

* 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 [ 527-60-6 ]

[ 527-60-6 ] Synthesis Path-Downstream   1~7

  • 1
  • [ 87-65-0 ]
  • [ 527-60-6 ]
  • [ 7462-76-2 ]
  • [ 15307-93-4 ]
YieldReaction ConditionsOperation in experiment
90.75% With sodium hydroxide; In water; N,N-dimethyl-formamide; toluene; EXAMPLE 1 Preparation of N-phenyl 2,6-dichloroaniline 37.6 g of 2,4,6-trimethyl phenol and 11 g of sodium hydroxide were dissolved in 30 ml of water and mixed with 150 ml of toluene. The toluene recovered from heating was mixed with 139 ml of N,N-dimethylformamide to obtain a N,N-dimethylformamide solution. 40 g of 2,6-dichlorophenol was dissolved in 130 ml of toluene, followed by the addition of 9.8 g of sodium hydroxide in 20 ml of water, 41.5 g of N-phenyl chloroacetamide and 8.7 ml of N,N-dimethylformamide, and refluxed in a oil bath at 140°-150° C. for 15 h. The toluene was recovered from the reflux, and mixed with the above N,N-dimethylformamide solution and reacted for 3 h. Recovering N,N-dimethylformamide from the reacted mixture with distillation under reduced pressure (145°-150° C., 8 mm Hg) resulted in the formation of 53 g of N-phenyl 2,6-dichloroaniline and the product yield was 90.75percent.
  • 2
  • [ 18740-39-1 ]
  • [ 527-60-6 ]
  • [ 1024603-81-3 ]
YieldReaction ConditionsOperation in experiment
97% A stirred suspension of NaH (9.5 mg, 0.24 mmol) in dry THF (1 mL) was added 2,4,6-trimethyl phenol(32.1 mg, 0.24 mmol) and stirred at room temperature for 30 min under Argon. The reaction mixture was added to a solution of 2,4-dichlorothieno[2,3-rf]pyrimidine (48.1 mg, 0.24 mmol) in dry THF (1.5 mL) at 0 0C and allow it to slowly warmed up to room temperature. After stirring the reaction for 4 h, the resulting mixture was diluted with water and washed with EtOAc. The combined organic layers were washed with water, brine, dried over Na2SO4, filtered and concentrated in vacuo. The crude product was purified by column chromatography, eluting with hexanes/ethyl acetate (9: 1 ) to give the product as a white solid (71 mg, 97percent):1H NMR (DMSO, 300 MHz) delta 2.0 (s, 6H), 2.27 (s, 3H), 6.98 (s, 2H), 7.65 (d, J = 6.0 Hz, IH), 7.75 (d, J = 5.7Hz, IH).
  • 3
  • [ 108-67-8 ]
  • [ 527-60-6 ]
  • [ 22445-42-7 ]
  • [ 5779-95-3 ]
  • [ 27129-87-9 ]
  • [ 88-05-1 ]
  • 4
  • [ 1293-65-8 ]
  • [ 527-60-6 ]
  • 1,1′-di(2,4,6-trimethylphenoxy)ferrocene [ No CAS ]
YieldReaction ConditionsOperation in experiment
23%Chromat. With copper(l) iodide; caesium carbonate; triphenylphosphine; In toluene; at 110℃; for 26h;Inert atmosphere; Schlenk technique; General procedure: In a Schlenk tube CuI (1.2 mg, 6.3 mumol, 5 mol. %), the respective ligand (10-15 mol. %), the respective ferrocenyl halide (0.125 mmol), the respective phenol (0.25-0.35mmol), and a base (0.25 mmol) were dissolved in toluene (7.5 mL), and the reaction mixture was stirred at 110C for a given time (26-60 h). After evaporation of the volatiles the crude products were purified by column chromatography in cyclohexane-ethyl acetate.
  • 5
  • [ 527-60-6 ]
  • [ 175711-83-8 ]
  • 2-(4-chloro-2-(mesityloxy)phenyl)-2-oxoacetic acid [ No CAS ]
  • 6
  • [ 527-60-6 ]
  • [ 175711-83-8 ]
  • C17H17ClO2 [ No CAS ]
  • 7
  • [ 67-56-1 ]
  • [ 90-05-1 ]
  • [ 576-26-1 ]
  • [ 527-60-6 ]
  • [ 2219-82-1 ]
  • [ 2416-94-6 ]
  • [ 2896-67-5 ]
  • [ 527-35-5 ]
 

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