ChemicalBook--->CAS DataBase List--->262368-47-8

262368-47-8

262368-47-8 Structure

262368-47-8 Structure
IdentificationBack Directory
[Name]

4-(2-MORPHOLIN-4-YL-ETHYL)-ANILINE
[CAS]

262368-47-8
[Synonyms]

4-(2-Morpholinoethyl)aniline
4-(2-Morpholinoethyl)phenylamine
4-[2-(4-Morpholinyl)ethyl]aniline
4-(2-MORPHOLIN-4-YL-ETHYL)-ANILINE
4-(2-Morpholin-4-yl-ethyl)-phenylamine
Benzenamine, 4-[2-(4-morpholinyl)ethyl]-
[Molecular Formula]

C12H18N2O
[MDL Number]

MFCD04114508
[MOL File]

262368-47-8.mol
[Molecular Weight]

206.28
Chemical PropertiesBack Directory
[Melting point ]

80.5-81.5℃
[Boiling point ]

343.6±27.0 °C(Predicted)
[density ]

1.090±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[form ]

solid
[pka]

7.43±0.10(Predicted)
[InChI]

InChI=1S/C12H18N2O/c13-12-3-1-11(2-4-12)5-6-14-7-9-15-10-8-14/h1-4H,5-10,13H2
[InChIKey]

LLPIMIMXCXEFER-UHFFFAOYSA-N
[SMILES]

C1(N)=CC=C(CCN2CCOCC2)C=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2934999090
Hazard InformationBack Directory
[Synthesis]

4-(4-nitrophenethyl) morpholine

210158-20-6

4-(2-MORPHOLIN-4-YL-ETHYL)-ANILINE

262368-47-8

General procedure: 4-(4-nitrophenylethyl)morpholine (2 g, 8.46 mmol) was mixed with 500 mg of Pd/C catalyst in 100 mL of methanol and the reaction was stirred at 45 psi hydrogen pressure for 16 hours. Upon completion of the reaction, the catalyst was removed by filtration to afford 4-(2-morpholin-4-ethyl)aniline (1.9 g, quantitative yield) as a white solid. The product was characterized by 1H NMR (300 MHz, CDCl3): δ 6.99 (d, J=9Hz, 2H), 6.62 (d, J=9Hz, 2H), 3.73 (m, 4H), 3.60 (brs, 2H), 2.70-2.65 (m, 2H), 2.54-2.47 (m, 6H).

[References]

[1] Angewandte Chemie, International Edition, 2012, vol. 51, # 42, p. 10500 - 10504,5
[2] Angewandte Chemie, 2012, vol. 124, # 42, p. 10652 - 10656,5
[3] Angewandte Chemie - International Edition, 2012, vol. 51, # 42, p. 10500 - 10504
[4] Angew. Chem., 2012, vol. 124, # 42, p. 10652 - 10656,5
[5] Patent: WO2013/43232, 2013, A2. Location in patent: Paragraph 00600
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