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Chemical Structure| 364750-80-1 Chemical Structure| 364750-80-1

Structure of 364750-80-1

Chemical Structure| 364750-80-1

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Product Details of [ 364750-80-1 ]

CAS No. :364750-80-1
Formula : C11H19NO4
M.W : 229.27
SMILES Code : O=C([C@H]1N(C(OC(C)(C)C)=O)C[C@H](C)C1)O
MDL No. :MFCD13185988
InChI Key :MXKSXPYZNXUHEZ-SFYZADRCSA-N
Pubchem ID :10911346

Safety of [ 364750-80-1 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Application In Synthesis of [ 364750-80-1 ]

* 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 [ 364750-80-1 ]

[ 364750-80-1 ] Synthesis Path-Downstream   1~3

  • 1
  • [ 61-90-5 ]
  • [ 24424-99-5 ]
  • [ 364750-81-2 ]
  • (2S)-2-(ter-butoxycarbonylamino)-4,4-dimethyl-4-butanolide [ No CAS ]
  • [ 364750-80-1 ]
  • 2
  • [ 364750-80-1 ]
  • [ 32968-78-8 ]
YieldReaction ConditionsOperation in experiment
31 g With hydrogenchloride; In diethyl ether; Step (i)[3]: To a stirred solution of NBoc diol (57 g, 262.52 mmol) in ether (150 mL) was addedHCl in ether (50 mL) and stirred for overnight. The white solid was filtered and washed withether (50 mL). The filtrate was kept at -0 oc for 6 hand the solid was filtered and washed withether (25 mL). Both batches were combined and dried in the presence of P20s under reducedpressure to constant weight 4 (31 g). 1H NMR (D20): 1.94-2.01 (m, 1H), 2.14-2.19 (m, 1H),3.30-3.48 (m, 2H), 3.71-3.76 (m, 1H), 3.93-4.08 (m, 2H), 4.67-4.75 (m, 1H).
  • 3
  • [ 89466-16-0 ]
  • [ 364750-80-1 ]
  • tert-butyl (2S,4R)-2-((6-bromo-3-methylpyridin-2-yl)carbamoyl)-4-methylpyrrolidine-1-carboxylate [ No CAS ]
YieldReaction ConditionsOperation in experiment
227 mg With pyridine; trichlorophosphate; In dichloromethane; at 0℃; for 4h; In a pre-dried flask, (2S,4R)-1-(tert-butoxycarbonyl)-4-methylpyrrolidine-2-carboxylic acid (purchased from Synthonix) (230 mg, 1.0 mmol), <strong>[89466-16-0]6-bromo-3-methylpyridin-2-amine</strong> (188 mg, 1.0 mmol) are placed, and then anhydrous DCM (15 mL) was added. The flask was placed in an ice bath. To the solution, dry pyridine (0.25 mL, 3.0 mmol) was added in one portion, followed by addition of POCl3(100 muL, 1.0 mmol). After completion of addition, the mixture was stirred for 4 hours at 0 C., and then the reaction was quenched with water (15 mL). The DCM layer was collected and the aqueous phase was extracted with DCM (15 mL×2). The combined DCM solution was washed with brine, and dried over MgSO4. The solution was filtered and concentrated; the resulting residue was purified to give 227 mg of pure product.1HNMR (400 MHz, DMSO-d6): (major rotamer) delta 0.99 (d, J=6.4 Hz, 3H), 1.36 (s, 9H), 1.82-1.93 (m, 1H), 2.02-2.06 (m, 1H), 2.11 (s, 3H), 2.30-2.37 (m, 1H), 2.86 (t, J=8.0 Hz, 1H), 3.57-3.61 (m, 1H), 4.35 (t, J=8.0 Hz, 1H), 7.43 (d, J=7.6 Hz, 1H), 7.63 (t, J=7.6 Hz, 1H), 10.25 ppm. LC (method A): tR=2.04 min. LC/MS (EI) m/z: [M+H]398.25
 

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