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3-(4-Nitrophenyl)-beta-alanine

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3-(4-Nitrophenyl)-beta-alanine Basic information

Product Name:
3-(4-Nitrophenyl)-beta-alanine
Synonyms:
  • RARECHEM AK HD C007
  • 3-AMINO-3-(4-NITROPHENYL)PROPANOIC ACID
  • 3-AMINO-3-(4-NITRO-PHENYL)-PROPIONIC ACID
  • 3-(P-NITROPHENYL)-DL-BETA-ALANINE
  • DL-3-AMINO-3-(4-NITRO-PHENYL)-PROPIONIC ACID
  • 3-(4-Nitrophenyl)-beta-alanine
  • (RS)-3-Amino-3-(4-nitrophenyl)-propionic acid
  • DL-3-Amino-3-(4-nitrophenyl)propanoic acid
CAS:
102308-62-3
MF:
C9H10N2O4
MW:
210.19
Product Categories:
  • B-Amino
  • API intermediates
Mol File:
102308-62-3.mol
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3-(4-Nitrophenyl)-beta-alanine Chemical Properties

Melting point:
226 °C (decomp)
Boiling point:
410.3±40.0 °C(Predicted)
Density 
1.404±0.06 g/cm3(Predicted)
storage temp. 
Keep in dark place,Inert atmosphere,Room temperature
pka
3.50±0.10(Predicted)
Appearance
White to light yellow Solid
CAS DataBase Reference
102308-62-3(CAS DataBase Reference)
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3-(4-Nitrophenyl)-beta-alanine Usage And Synthesis

Synthesis

141-82-2

555-16-8

102308-62-3

General procedure for the synthesis of 3-amino-3-(4-nitrophenyl)propionic acid from malonic acid and p-nitrobenzaldehyde: A mixture of 2.40 g of p-nitrobenzaldehyde, 2.44 g of malonic acid, and 3.54 g of ammonium acetate (molar ratio 1:1.1:2.3) was dissolved in 200 mL of 1 -butanol, and the reaction was carried out at reflux for 1.5-2 hr until the release of carbon dioxide gas stopped. Upon completion of the reaction, the precipitate formed was filtered and washed sequentially with boiling 1-butanol (2 x 50 mL), boiling ethanol (2 x 50 mL) and 100 mL of water. The precipitate was dried at 80-100°C for 8-10 hours. The purity of the product was checked by thin layer chromatography (TLC) and the reaction yield was about 65-80%.

References

[1] European Journal of Medicinal Chemistry, 2018, vol. 156, p. 252 - 268

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