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103041-38-9

103041-38-9 Structure

103041-38-9 Structure
IdentificationBack Directory
[Name]

N-[2]PYRIDYL-B-ALANIN-ETHYL ESTER
[CAS]

103041-38-9
[Synonyms]

3-(Pyridin-2-ylamino)propanoate
Dabigatran Etexilate Impurity 90
Ethyl 3-(pyridin-2-ylamino)propan
N-[2]PYRIDYL-B-ALANIN-ETHYL ESTER
N-2-pyridinyl-β-Alanine,ethylester
Ethyl 3-(2-PyridylaMino)propanoate
Dabigatran Etexilate Intermdiate 4
Ethyl 3-(2-Pyridylamino)propionate
N-2-Pyridinyl-b-alanine ethyl ester
N-2-Pyridyl-beta-alanin ethyl ester
ethyl 3-(pyridin-2-ylamino)propanoate
Ethyl-3-(pyridin-2yl-Amino)propionate
N-2-pyridinyl-, ethyl ester Alanine
β-Alanine, N-2-pyridinyl-, ethyl ester
N-2-Pyridinyl-beta-alanine ethyl ester
Ethyl-3-(pyridine-2-ylamino)propanoate
N-Ethyl 3-(pyridin-2-ylaMino)propanoate
N-Pyridin-2-yl-beta-alanine ethyl ester
N-[2]PYRIDYL-B-ALANIN-ETHYL ESTER USP/EP/BP
3-(2-Pyridylamino)propionic Acid Ethyl Ester
ethyl (2R)-2-[(pyridin-2-yl)amino]propanoate
ethyl (2S)-2-[(pyridin-2-yl)aMino]propanoate
3-(Pyridin-2-ylaMino)-propionic acid ethyl ester
[EINECS(EC#)]

600-382-4
[Molecular Formula]

C10H14N2O2
[MDL Number]

MFCD09833621
[MOL File]

103041-38-9.mol
[Molecular Weight]

194.23
Chemical PropertiesBack Directory
[Melting point ]

48-50°C
[Boiling point ]

125°C/0.2mmHg(lit.)
[density ]

1.131±0.06 g/cm3(Predicted)
[storage temp. ]

Refrigerator
[solubility ]

DMSO, Methanol
[form ]

Solid
[pka]

6.26±0.10(Predicted)
[color ]

White
[InChI]

InChI=1S/C10H14N2O2/c1-2-14-10(13)6-8-12-9-5-3-4-7-11-9/h3-5,7H,2,6,8H2,1H3,(H,11,12)
[InChIKey]

UITNIDFEANEWPC-UHFFFAOYSA-N
[SMILES]

C(OCC)(=O)CCNC1C=CC=CN=1
[LogP]

1.54 at 22℃ and pH6
Safety DataBack Directory
[HS Code ]

2933.39.9200
Hazard InformationBack Directory
[Chemical Properties]

White Solid
[Uses]

Dabigatran etexilate intermediate
[Uses]

Ethyl 3-(2-Pyridylamino)propanoate is an intermediate used in the synthesis of Dabigatran etexilate, as thrombin inhibitors. Ethyl Ester form of P993315.
[Synthesis]

A method for preparing Ethyl 3-(pyridin-2-ylamino)propanoate comprises the following steps: using 2-aminopyridine and ethyl acrylate as raw materials, using anhydrous ethanol as a solvent, using trifluoromethanesulfonic acid as a catalyst, and heating in an oil bath to control the temperature at 120 to 160° C. for a catalytic reaction for 16 to 20 hours under nitrogen protection. The obtained reaction solution is washed with petroleum ether at a temperature of 35 to 40° C. and a pressure of 0.09 to 0.1 MPa, then concentrated under reduced pressure, and then washed with petroleum ether/ethyl acetate and recrystallized to obtain white flaky crystals of Ethyl 3-(pyridin-2-ylamino)propanoate.
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