1-PYRIMIDIN-2-YL-PIPERIDINE-4-CARBOXYLIC ACID ETHYL ESTER
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1-PYRIMIDIN-2-YL-PIPERIDINE-4-CARBOXYLIC ACID ETHYL ESTER
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CAS No:
111247-60-0
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Formula:
C12H17N3O2
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Chemical Name:
1-PYRIMIDIN-2-YL-PIPERIDINE-4-CARBOXYLIC ACID ETHYL ESTER
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Synonyms:
4-Piperidinecarboxylic acid, 1-(2-pyriMidinyl)-, ethyl ester;1-PYRIMIDIN-2-YL-PIPERIDINE-4-CARBOXYLIC ACID ETHYL ESTER;BUTTPARK 90\06-42;1-Pyrimidin-2-yl-piperidine-4-carboxylicacidethylester95%;ETHYL1-PYRIMIDIN-2-YLPIPERIDINE-4-CARBOXYLATE;1-PYRIMIDIN-2-YL-PIPERIDINE-4-CARBOXYLIC ACID ETHYL ESTER 95%
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CAS No:
1-PYRIMIDIN-2-YL-PIPERIDINE-4-CARBOXYLIC ACID ETHYL ESTER Basic Attributes
235.28
235.13200
DTXSID10426550
2933990090
Characteristics
55.3
1.4
1.163±0.06 g/cm3(Predicted)
373.4±52.0 °C(Predicted)
179.6ºC
1.533
8.98E-06mmHg at 25°C
1-PYRIMIDIN-2-YL-PIPERIDINE-4-CARBOXYLIC ACID ETHYL ESTER Use and Manufacturing
Method ACompound 1: l-Pyrimidin-2-yl-piperidine-4-carboxylic acid ethyl esterA mixture of 2-chloropyrimidine (2.28g, 20mmol) and ethyl isonipecotate (4.72g, 30mmol) in toluene (10ml) was heated at reflux for 18 h. then cooled to RT. The mixture was diluted with EtOAc and washed with saturated aqueous NaHCOMethod ACompound 1: l-Pyrimidin-2-yl-piperidine-4-carboxylic acid ethyl esterA mixture of 2-chloropyrimidine (2.28g, 20mmol) and ethyl isonipecotate (4.72g, 30mmol) in toluene (10ml) was heated at reflux for 18 h. then cooled to RT. The mixture was diluted with EtOAc and washed with saturated aqueous NaHCO
Computed Properties
Molecular Weight:235.28
XLogP3:1.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:235.132076794
Monoisotopic Mass:235.132076794
Topological Polar Surface Area:55.3
Heavy Atom Count:17
Complexity:246
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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