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Chemical Structure| 1301713-93-8 Chemical Structure| 1301713-93-8

Structure of 1301713-93-8

Chemical Structure| 1301713-93-8

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Product Details of [ 1301713-93-8 ]

CAS No. :1301713-93-8
Formula : C10H15N3O2
M.W : 209.25
SMILES Code : O=C(C1=NN2C(CNCCC2)=C1)OCC

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Application In Synthesis of [ 1301713-93-8 ]

* 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 [ 1301713-93-8 ]

[ 1301713-93-8 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 60211-57-6 ]
  • [ 1301713-93-8 ]
  • [ 530-62-1 ]
  • 5-(3,5-dichlorobenzyl) 2-ethyl 7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepine-2,5(6H)-dicarboxylate [ No CAS ]
YieldReaction ConditionsOperation in experiment
33% To a mixture of <strong>[60211-57-6](3,5-dichloro-phenyl)-methanol</strong> (97 mg, 0.55 mmol) and N,N- carbonyldiimidazole (89 mg, 0.55 mmol) in DMF (2 mL) was added triethylamine (139 mu, 1.00 mmol). The reaction mixture was stirred at rt for lh. It was then added a solution of ethyl 5,6,7, 8-tetrahydro-4H-pyrazolo[l,5-a][l,4]diazepine-2-carboxylate (105 mg, 0.50 mmol) in DMF ( 1 mL). The reaction mixture was stirred at rt over weekend. It was purified by prep-HPLC (MeCN/H20 with 0.1% TFA) to get the desired ester as a white powder after lyophilization (68 mg, yield 33%). 1H NMR (400 MHz, METHANOL-d4) delta 7.11 - 7.42 (m, 3H), 6.72, 6.66 (s, s, 1H), 5.10, 5.06 (s, s, 2H), 4.65, 4.53 (s, s, 2H), 4.46 - 4.54 (m, 2H), 4.32 (q, J = 7.03 Hz, 2H), 3.69 - 3.94 (m, 2H), 1.85- 1.95 (m, 2H), 1.35 (t, J = 7.03 Hz, 3H); LCMS m/z 411.9 [M+H]+.
 

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