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Chemical Structure| 19036-43-2 Chemical Structure| 19036-43-2

Structure of 19036-43-2

Chemical Structure| 19036-43-2

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Product Details of [ 19036-43-2 ]

CAS No. :19036-43-2
Formula : C5H11NO2
M.W : 117.15
SMILES Code : CC(C)(CN)C(O)=O
MDL No. :MFCD09055365
InChI Key :DGNHGRLDBKAPEH-UHFFFAOYSA-N
Pubchem ID :95739

Safety of [ 19036-43-2 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H312-H332
Precautionary Statements:P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501

Application In Synthesis of [ 19036-43-2 ]

* 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 [ 19036-43-2 ]

[ 19036-43-2 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 19036-43-2 ]
  • [ 24424-99-5 ]
  • [ 180181-02-6 ]
YieldReaction ConditionsOperation in experiment
91% With N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 60℃; for 16h; Example 6: Synthesis of 3-(tert-butoxycarbonylamino)-2,2-dimethylpropanoic acid (19)[00156] 3-Amino-2,2-dimethylpropanoic acid (18) (1.2 g, 10.2 mmol), Boc anhydride (2.3 g, 10.2 mmol) and DIPEA (1.85 mL, 10.23 mmol) were stirred under argon in DMF (30 mL) at 60 C for 16 h. The reaction was concentrated in vacuo, taken up in EtOAc, washed with saturated NH4C1 solution, and concentrated in vacuo to give 3-(teri-butoxycarbonylamino)-2,2-dimethylpropanoic acid (19) (2.0 g, 91 %); 1H NMR (300 mHz - CDCl3) 6 1.33 (s, 6 H), 1.37 (s, 9 H), 2.69 (s, 2 H).
63% With sodium hydroxide; In water; tert-butyl alcohol; at 20℃; for 16h; Preparational Example 21 Preparation of 3-(t-butoxycarbonylamino)-2,2-dimethylpropanoic acid 256 mg (2.22 mmol) of the -amino-2,2-dimethylpropanoic acid prepared in Preparational Example 20 was dissolved in 2.0 ml of water and 3.0 ml of t-BuOH, to which 4.0 ml of 1.0 N NaOH solution and 725 mg (3.32 mmol) of Boc2O were added. The mixture was stirred at room temperature for 16 hours, followed by evaporation under reduced pressure to eliminate the solvent. The residue was acidized with 1 N HCl to be pH 3, followed by extraction with 320 ml of ethyl acetate. The extract was dried over anhydrous magnesium sulfate, followed by evaporation under reduced pressure to give 305 mg of 3-(t-butoxycarbonylamino)-2,2-dimethylpropanoic acid (yield: 63%). 1H NMR (400 MHz, CDCl3) delta 3.25 (s, 2H), 1.44 (s, 9H), 1.18 (s, 6H)
63% With sodium hydroxide; In water; tert-butyl alcohol; at 20℃; for 16h; 256 mg (2.22 mmol) of the -amino-2,2-dimethylpropanoic acid prepared in Preparational Example 20 was dissolved in 2.0 ml of water and 3.0 ml of t-BuOH, to which 4.0 ml of 1.0 N NaOH solution and 725 mg (3.32 mmol) of Boc2O were added. The mixture was stirred at room temperature for 16 hours, followed by evaporation under reduced pressure to eliminate the solvent. The residue was acidized with 1 N HCl to be pH 3, followed by extraction with 320 ml of ethyl acetate. The extract was dried over anhydrous magnesium sulfate, followed by evaporation under reduced pressure to give 305 mg of 3-(t-butoxycarbonylamino)-2,2-dimethylpropanoic acid (yield: 63%). 1H NMR (400 MHz, CDCl3) delta 3.25 (s, 2H), 1.44 (s, 9H), 1.18 (s, 6H)
  • 2
  • [ 19036-43-2 ]
  • [ 1455091-10-7 ]
  • [ 1455086-87-9 ]
YieldReaction ConditionsOperation in experiment
81% With sodium methylate; In methanol; at 120℃; for 1h;Microwave irradiation; A mixture of 4-hydroxy-7-phenoxy-isoquinoline-3-carboxylic acid methyl ester (68 mg, 0.23 mmol) and 3-amino-2,2-dimethyl-propionic acid (81 mg, 0.69 mmol) (ChemBridge) in 0.5 N NaOMe in MeOH solution (0.92 mL, 0.46 mmol) was microwaved at 120 C for 1 h. Reaction mixture was diluted with water (50 mL) and acidified by 1 N HC1 solution to pH = 3-4. Precipitate was collected and rinsed with water and dried in vacuo to provide the title compound (71 mg, 0.19 mmol) as an off- white solid in 81% yield. LC-MS ESI-: 379.04 (M-l)
 

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