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Chemical Structure| 5692-35-3 Chemical Structure| 5692-35-3

Structure of 5692-35-3

Chemical Structure| 5692-35-3

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Product Details of [ 5692-35-3 ]

CAS No. :5692-35-3
Formula : C9H11NO
M.W : 149.19
SMILES Code : O=C(N)C1=CC(C)=CC(C)=C1
MDL No. :MFCD11643198

Safety of [ 5692-35-3 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H319
Precautionary Statements:P264-P270-P280-P301+P312+P330-P305+P351+P338-P337+P313-P501

Application In Synthesis of [ 5692-35-3 ]

* 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 [ 5692-35-3 ]

[ 5692-35-3 ] Synthesis Path-Downstream   1~3

  • 1
  • [ 5692-35-3 ]
  • [ 22445-42-7 ]
YieldReaction ConditionsOperation in experiment
95% With thionyl chloride;N,N-dimethyl-formamide; In benzene; for 2h;Heating / reflux; 3,5-dimethylbenzonitrile; 3,5-dimethylbenzamide (50 g, 0.3356M) was suspended in benzene (400 mL). Thionyl chloride (49 mL, 0.671M) and DMF (2 mL) were added and the mixture was refluxed for 2 hr. After cooling to room temperature, the mixture was poured into a crushed ice. After 1 hr., the solution was neutralized by the addition of 6N sodium hydroxide solution. The product was then extracted with ether, dried with anhydrous magnesium sulfate, filtered, and evaporated in vacuo to give a yellow solid. The crude product was then purified by silica gel column chromatography (eluent, EA:hexane (1:4)) to afford 42 g (95%) of 3,5-dimethylbenzonitrile as a yellow solid. m.p. 51-52 C. 1H NMR (300 MHz, CDCl3) delta 2.34(6H, s), 7.21 (1H, s), 7.26 (2H, s).
  • 2
  • [ 108-67-8 ]
  • [ 22445-42-7 ]
  • [ 5779-95-3 ]
  • [ 5692-35-3 ]
  • 3
  • [ 22445-42-7 ]
  • [ 5692-35-3 ]
YieldReaction ConditionsOperation in experiment
84% With Acetaldehyde oxime; [(eta.(5)-pentamethylcyclopentadienyl)Rh(H2O)3](OTf)2; In water; at 50℃; for 6h;Schlenk technique; A solution of <strong>[22445-42-7]3,5-dimethylbenzonitrile</strong> (131 mg, 1 mmol), [Cp * Rh (H2O)3] [OTf]2(3.0 mg, 0.005 mmol, 0.5 mol%), acetaldehyde oxime (65 mg, 1.1 mmol) and water (1 ml) were successively added to a 25 ml Schlenk reaction flask.The reaction mixture was reacted at 50 C for 6 hours and then cooled to room temperature., The water was removed by rotary evaporation to remove the target product, yield: 84%
 

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