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[ CAS No. 132664-85-8 ] {[proInfo.proName]}

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Chemical Structure| 132664-85-8
Chemical Structure| 132664-85-8
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Product Details of [ 132664-85-8 ]

CAS No. :132664-85-8 MDL No. :MFCD01314542
Formula : C6H9N3 Boiling Point : -
Linear Structure Formula :- InChI Key :MPBCUCGKHDEUDD-UHFFFAOYSA-N
M.W : 123.16 Pubchem ID :2756496
Synonyms :

Safety of [ 132664-85-8 ]

Signal Word:Danger Class:8,6.1
Precautionary Statements:P261-P280-P301+P310-P305+P351+P338 UN#:2922
Hazard Statements:H301-H315-H318-H335 Packing Group:Ⅲ
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Application In Synthesis of [ 132664-85-8 ]

* 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 [ 132664-85-8 ]

[ 132664-85-8 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 1138555-04-0 ]
  • [ 132664-85-8 ]
  • [ 1138549-36-6 ]
YieldReaction ConditionsOperation in experiment
With aluminum (III) chloride; 1,8-diazabicyclo[5.4.0]undec-7-ene; In dichloromethane; at 20℃; for 0.5h;Product distribution / selectivity; To a solution of ester (2.85 mg, 6.53 mmol), (5-methylpyrazin-2-yl)methanamine (2.45 mL), and DBU (2.93 mL) in DCM (100 mL) was added AlCl3 (2.67 g). The reaction mixture was stirred at rt for 30 min. The reaction was diluted with DCM (100 mL) and 4N NaOH (100 mL) and stirred for 15 min. The layers were separated and the organic layer was washed with H2O (2×100 mL), brine (100 mL), and dried over Na2SO4. The solvent was removed under reduced pressure and the resulting solid was triturated in ACN to give the desired product as a white solid (1.98 g). LCMS (ES): m/z 514 [M+1]+. To a solution of ester (2.24 g, 5.15 mmol), 2-(aminomethyl)-5-methylpyrazine (1.27 g, 10.32 mmol) and DBU (2.3 mL, 15.38 mmol) in DCM (50 mL) was added AlCl3 (2.05 g, 15.39 mmol). The reaction mixture was stirred at rt for 30 min. The reaction was diluted with DCM (200 mL) and 3N NaOH (50 mL) and stirred for 10 min. The layers were separated and the organic layer was washed with H2O (2×100 mL), brine (100 mL), and dried over Na2SO4. The solvent was removed under reduced pressure and the resulting solid was triturated in ACN to give the desired product (1.80 g) as a pale yellow solid. 1H NMR (CDCl3) delta: 11.28 (t, 1H), 9.52 (d, 1H), 8.57 (m, 2H), 8.45 (d, 1H), 7.74 (m, 1H), 7.44 (m, 2H), 6.78 (d, 1H), 4.86 (d, 2H), 3.90 (br, 4H), 2.86 (m, 2H), 2.65 (m, 2H), 2.56 (s, 3H), 2.42 (s, 3H), 2.15 (m, 2H). LCMS (ES): m/z 485 [M+1]+. LCMS (ES): m/z 514 [M+1]+.
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