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CS-W001157 4
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3-Amino-3-(4-ethoxy-3-methoxyphenyl)propanoic acid

  • CAS No. 54503-18-3

  • Cat. No. CS-0299267
  • Molecule weight239.27
  • Purity95+%
  • MDL No.None

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

3-Amino-3-(4-ethoxy-3-methoxyphenyl)propanoic acid|CS-0299267

Structure of 54503-18-3

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General Information

  • CAS No. 54503-18-3
  • Cat. No. CS-0299267
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₇NO₄
  • Molecular Weight 239.27
  • Synonym(s) 3-azaniumyl-3-(4-ethoxy-3-methoxy-phenyl)propanoate
  • SMILES CCOC1=C(C=C(C=C1)C(CC(=O)O)N)OC

Synthesis

  • Route1
    • null|null
      141-82-2
    • In-stock
      4-Ethoxy-3-methoxybenzaldehyde|CS-0075664
      120-25-2
    • ~62%
    • 3-Amino-3-(4-ethoxy-3-methoxyphenyl)propanoic acid|CS-0299267
      54503-18-3
    • (2E)-3-(4-Ethoxy-3-methoxyphenyl)acrylic acid|CS-0116978
      144878-40-0

    References

    • Russian Journal of General Chemistry, , vol. 75, # 7 p. 1113 - 1124
  • Route2
    • Vanillin, ≥97%|CS-1268660
      121-33-5
    • ~%
    • 3-Amino-3-(4-ethoxy-3-methoxyphenyl)propanoic acid|CS-0299267
      54503-18-3

    References

    • Russian Journal of General Chemistry, , vol. 75, # 7 p. 1113 - 1124

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   81.78
  • LogP   1.5684
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   6

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