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[ CAS No. 73013-69-1 ] {[proInfo.proName]}

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3d Animation Molecule Structure of 73013-69-1
Chemical Structure| 73013-69-1
Chemical Structure| 73013-69-1
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Product Details of [ 73013-69-1 ]

CAS No. :73013-69-1 MDL No. :MFCD11520855
Formula : C11H8N2 Boiling Point : -
Linear Structure Formula :- InChI Key :RGNLKYMDERTWSG-UHFFFAOYSA-N
M.W : 168.19 Pubchem ID :350484
Synonyms :

Safety of [ 73013-69-1 ]

Signal Word:Warning Class:
Precautionary Statements:P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501 UN#:
Hazard Statements:H302-H312-H332 Packing Group:
GHS Pictogram:

Application In Synthesis of [ 73013-69-1 ]

* 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 [ 73013-69-1 ]

[ 73013-69-1 ] Synthesis Path-Downstream   1~19

YieldReaction ConditionsOperation in experiment
6-Chinolincarbonitril Va, CH3-Mg-I;
  • 2
  • [ 877-42-9 ]
  • [ 544-92-3 ]
  • [ 73013-69-1 ]
YieldReaction ConditionsOperation in experiment
75% With pyridine at 200℃; for 24h;
  • 3
  • [ 73013-69-1 ]
  • [ 74-88-4 ]
  • 6-cyano-1,2-dimethyl-quinolinium; iodide [ No CAS ]
YieldReaction ConditionsOperation in experiment
75% at 100 - 105℃; for 12h;
  • 4
  • [ 73013-69-1 ]
  • C28H18N4O2 [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: 75 percent / 12 h / 100 - 105 °C 2: 84 percent / tributylorthoformate; quinoline / benzene; butan-1-ol / 6 h / 60 - 70 °C
  • 5
  • [ 106-40-1 ]
  • [ 73013-69-1 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: aq. HCl / 6 h / Heating 2: 75 percent / pyridine / 24 h / 200 °C
  • 6
  • [ 95-46-5 ]
  • [ 73013-69-1 ]
  • [ 1256347-72-4 ]
YieldReaction ConditionsOperation in experiment
56% With bis(3,5,3′,5′-dimethoxydibenzylideneacetone)palladium(0); caesium carbonate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene In 1,4-dioxane at 100℃; for 16h; Inert atmosphere;
  • 7
  • [ 73013-69-1 ]
  • [ 201733-56-4 ]
  • [ 1352304-55-2 ]
YieldReaction ConditionsOperation in experiment
82% With [RhCl(cod)]2; Xantphos; DABCO In toluene 100°C, 15 h;
82% With 1,4-diaza-bicyclo[2.2.2]octane; chloro(1,5-cyclooctadiene)rhodium(I) dimer; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene In toluene at 100℃; for 15h; Inert atmosphere;
  • 8
  • [ 635-80-3 ]
  • [ 73013-69-1 ]
  • 9
  • [ 108166-01-4 ]
  • [ 73013-69-1 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: ammonium hydroxide / methanol / 12 h / 45 °C 2: triethylamine; trifluoroacetic anhydride / chloroform / 1.5 h / 10 °C
Multi-step reaction with 2 steps 1: ammonium hydroxide / methanol / 12 h / 45 °C 2: trifluoroacetic anhydride; triethylamine / chloroform / 1.5 h / 10 °C
  • 10
  • [ 37535-43-6 ]
  • [ 73013-69-1 ]
YieldReaction ConditionsOperation in experiment
77% With triethylamine; trifluoroacetic anhydride In chloroform at 10℃; for 1.5h; 13.4 Step 4: 2-methylquinoline-6-carbonitrile: Step 4: 2-methylquinoline-6-carbonitrile: To a solution of 2-methylquinoline-6-carboxamide (1.0 g, 5.36 mmol) in chloroform (5 ml.) and triethylamine (2.71 g, 26.84 mmol), trifluoroacetic anhydride (2.81 g, 13.42 mmol) was added dropwise below 10°C. After 1.5h, the pH was adjusted to 7 with sodium bicarbonate solution and extracted with dichloromethane. The organic layer was dried with sodium sulphate and concentrated to afford the title compound as a yellow solid (0.70 g, 77%).
77% With triethylamine; trifluoroacetic anhydride In chloroform at 10℃; for 1.5h; 4 Step 4: Step 4: 2-methylquinoline-6-carbonitrile To a solution of 2-methylquinoline-6-carboxamide (1.0 g, 5.36 mmol) in chloroform (5 ml.) and triethylamine (2.71 g, 26.84 mmol), trifluoroacetic anhydride (2.81 g, 13.42 mmol) was added dropwise below 10° C. After 1.5 h, the pH was adjusted to 7 with sodium bicarbonate solution and extracted with dichloromethane. The organic layer was dried with sodium sulphate and concentrated to afford the title compound as a yellow solid (0.70 g, 77%).
  • 11
  • [ 73013-69-1 ]
  • [ 1369207-07-7 ]
YieldReaction ConditionsOperation in experiment
97% With ammonia; hydrogen In methanol at 20℃; for 16h; 13.5 Step 5: (2-methylquinolin-6-yl)methanamine: Step 5: (2-methylquinolin-6-yl)methanamine: To a solution of 2-methylquinoline-6- carbonitrile (0.700 g, 4.16 mmol) in saturated ammonia in methanol (10 ml ), Raney-Ni (1.4g) was added and the mixture was stirred at 1 atm of at RT for 16h. The reaction mixture was filtered and the filtrate was concentrated under vacuum to afford the title compound as a brown oil (0.700 g, 97%). 'H-NMR (δ ppm, DMSO-d6, 400 MHz): 8.83 (dd, J = 4.2, 1.7 Hz, 1H), 8.29 (d, J = 8.3 Hz, 1H), 7.95 (d, J = 8.6 Hz, 1H), 7.85 (s, 1H), 7.75 (dd J = 8.7,1.8 Hz, 1H), 7.49 (dd, J = 8.2,4.2 Hz, 1H), 3.90 (s, 2H).
97% With ammonia; hydrogen In methanol at 20℃; for 16h; 5 Step 5:
(2-methylquinolin-6-yl)methanamine Step 5: (2-methylquinolin-6-yl)methanamine To a solution of 2-methylquinoline-6-carbonitrile (0.700 g, 4.16 mmol) in saturated ammonia in methanol (10 ml), Raney-Ni (1.4 g) was added and the mixture was stirred at 1 atm of H2 at RT for 16 h. The reaction mixture was filtered and the filtrate was concentrated under vacuum to afford the title compound as a brown oil (0.700 g, 97%). 1H-NMR (δ ppm, DMSO-d6, 400 MHz): 8.83 (dd, J=4.2, 1.7 Hz, 1H), 8.29 (d, J=8.3 Hz, 1H), 7.95 (d, J=8.6 Hz, 1H), 7.85 (s, 1H), 7.75 (dd J=8.7, 1.8 Hz, 1H), 7.49 (dd, J=8.2, 4.2 Hz, 1H), 3.90 (s, 2H).
  • 12
  • [ 150-13-0 ]
  • [ 73013-69-1 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 4 steps 1.1: hydrogenchloride / water / 2 h / Reflux 1.2: 12.75 h 2.1: sulfuric acid / 12 h / 0 - 65 °C 3.1: ammonium hydroxide / methanol / 12 h / 45 °C 4.1: triethylamine; trifluoroacetic anhydride / chloroform / 1.5 h / 10 °C
Multi-step reaction with 4 steps 1.1: hydrogenchloride / water / 2 h / Reflux 1.2: 12 h 2.1: sulfuric acid / 12 h / 0 - 65 °C 3.1: ammonium hydroxide / methanol / 12 h / 45 °C 4.1: trifluoroacetic anhydride; triethylamine / chloroform / 1.5 h / 10 °C
  • 13
  • [ 557-21-1 ]
  • [ 877-42-9 ]
  • [ 73013-69-1 ]
YieldReaction ConditionsOperation in experiment
95% With [(2-di-tert-butylphosphino-2′,4′,6′-triisopropyl-1, 1′-biphenyl)-2-(2′-amino-1,1′-biphenyl)] palladium(II) methanesulfonate In tetrahydrofuran; water at 40℃; for 18h; Inert atmosphere;
  • 14
  • [ 33348-34-4 ]
  • [ 73013-69-1 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: dichlorobis(tri-O-tolylphosphine)palladium; triethylamine / acetonitrile / 24 h / Inert atmosphere; Reflux 2: tetrahydrofuran / 12 h / Irradiation
  • 15
  • (E)-4-amino-3-(3-oxobut-1-en-1-yl)benzonitrile [ No CAS ]
  • [ 73013-69-1 ]
YieldReaction ConditionsOperation in experiment
86% In tetrahydrofuran for 12h; Irradiation;
  • 16
  • [ 67-56-1 ]
  • [ 73013-69-1 ]
  • 6-cyano-4-hydroxymethyl-2-methylquinoline [ No CAS ]
YieldReaction ConditionsOperation in experiment
38% With sodium persulfate In water at 70℃; for 4h; Inert atmosphere;
  • 17
  • [ 73013-69-1 ]
  • [ 99802-91-2 ]
  • 2-(4-(1-methyl-1H-imidazol-2-yl)-4-oxo-2-phenylbutyl)quinoline-6-carbonitrile [ No CAS ]
  • 2-(4-(1-methyl-1H-imidazol-2-yl)-4-oxo-2-phenylbutyl)quinoline-6-carbonitrile [ No CAS ]
YieldReaction ConditionsOperation in experiment
With C50H46IrN4O2(1+)*F6P(1-); scandium tris(trifluoromethanesulfonate) In tetrahydrofuran at 120℃; for 20h; Inert atmosphere; Sealed tube; Overall yield = 82 percent; Overall yield = 31.2 mg; Optical yield = 74.8 percent ee; enantioselective reaction;
  • 18
  • [ 73013-69-1 ]
  • [ 99802-91-2 ]
  • 2-(4-(1-methyl-1H-imidazol-2-yl)-4-oxo-2-phenylbutyl)quinoline-6-carbonitrile [ No CAS ]
YieldReaction ConditionsOperation in experiment
With C38H38N4RhS2(1+)*F6P(1-); scandium tris(trifluoromethanesulfonate) In tetrahydrofuran at 120℃; for 20h; Inert atmosphere; Sealed tube;
  • 19
  • [ 109-92-2 ]
  • [ 873-74-5 ]
  • [ 73013-69-1 ]
YieldReaction ConditionsOperation in experiment
Stage #1: ethyl vinyl ether; 4-Aminobenzonitrile With acetic acid at 25℃; for 6h; Inert atmosphere; Stage #2: for 5h; Inert atmosphere; Reflux;
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