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3-Amino-3-(5-chloro-2-nitrophenyl)propanoic acid

  • CAS No. 63235-32-5

  • Cat. No. CS-0524620
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

3-Amino-3-(5-chloro-2-nitrophenyl)propanoic acid|CS-0524620

Structure of 63235-32-5

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General Information

  • CAS No. 63235-32-5
  • Cat. No. CS-0524620
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉ClN₂O₄
  • Molecular Weight 244.63
  • Synonym(s) 3-AMINO-3-(5-CHLORO-2-NITRO-PHENYL)-PROPIONIC ACID
  • SMILES O=C(O)CC(N)C1=CC(Cl)=CC=C1[N+]([O-])=O

Synthesis

  • Route1

    References

    • Adir et Compagnie Patent: US5703070 A1, 1997 ;
  • Route2

    References

    • Mylari, Banavara L.; Zembrowski, William J.; Beyer, Thomas A.; Aldinger, Charles E.; Siegel, Todd W. Journal of Medicinal Chemistry, 1992 , vol. 35, # 12 p. 2155 - 2162

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   106.46
  • LogP   1.7227
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   4

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