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CAS No. : | 915226-44-7 | MDL No. : | MFCD05864632 |
Formula : | C11H18N2O2 | Boiling Point : | 325.3°C at 760 mmHg |
Linear Structure Formula : | - | InChI Key : | UEFZTXGFHKPSFS-VIFPVBQESA-N |
M.W : | 210.27 | Pubchem ID : | 7019448 |
Synonyms : |
|
TPSA :Topological Polar Surface Area | 53.3 | H-Bond Acceptor Count : | 3 |
XLogP3 : | 1.3 | H-Bond Donor Count : | 0 |
SP3 : | 0.82 | Rotatable Bond Count : | 2 |
Signal Word: | Warning | Class | N/A |
Precautionary Statements: | P261-P305+P351+P338 | UN#: | N/A |
Hazard Statements: | H302-H315-H319-H335 | Packing Group: | N/A |
GHS Pictogram: |
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Yield | Reaction Conditions | Operation in experiment |
---|---|---|
100% | at 0 - 20℃; | 2(B) (R)-3-Cyano-piperidine-1-carboxylic acid tert-butyl ester Phosphorus oxychloride (203 μL, 2.18 mmol) was added dropwise at 0° C. to a solution of (R)-3-carbamoyl-piperidine-1-carboxylic acid tert-butyl ester (0.5 g, 2.18 mmol) in pyridine (10 mL), under nitrogen atmosphere. After stirring overnight at room temperature, ethyl acetate was added and the solution was washed with 10percent HCl (2 times). The phases were separated and the organics were dried over sodium sulphate and evaporated to dryness under reduced pressure. The title compound was used for the next step without further purification. Yield: quantitative; LCMS (T): 4.48 min (Method A); MS (ES+) gave m/z: 211.1. |
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
100% | at 0 - 20℃; | 2(B) (R)-3-Cyano-piperidine-1-carboxylic acid tert-butyl ester Phosphorus oxychloride (203 μL, 2.18 mmol) was added dropwise at 0° C. to a solution of (R)-3-carbamoyl-piperidine-1-carboxylic acid tert-butyl ester (0.5 g, 2.18 mmol) in pyridine (10 mL), under nitrogen atmosphere. After stirring overnight at room temperature, ethyl acetate was added and the solution was washed with 10percent HCl (2 times). The phases were separated and the organics were dried over sodium sulphate and evaporated to dryness under reduced pressure. The title compound was used for the next step without further purification. Yield: quantitative; LCMS (T): 4.48 min (Method A); MS (ES+) gave m/z: 211.1. |
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