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CS-W001157 4
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Ethyl 3-amino-3-(benzo[d][1,3]dioxol-5-yl)propanoate hydrochloride

  • CAS No. 149498-94-2

  • Cat. No. CS-0334036
  • Molecule weight273.71
  • Purity95+%
  • MDL No.None

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

Ethyl 3-amino-3-(benzo[d][1,3]dioxol-5-yl)propanoate hydrochloride|CS-0334036

Structure of 149498-94-2

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General Information

  • CAS No. 149498-94-2
  • Cat. No. CS-0334036
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆ClNO₄
  • Molecular Weight 273.71
  • Synonym(s) 3-Amino-3-benzo[1,3]dioxol-5-yl-propionic acidethyl ester hydrochloride
  • SMILES CCOC(=O)CC(C1=CC2=C(C=C1)OCO2)N.Cl

Synthesis

  • Route1
    • null|null
      120-57-0
    • ~%
    • Ethyl 3-amino-3-(benzo[d][1,3]dioxol-5-yl)propanoate hydrochloride|CS-0334036
      149498-94-2

    References

    • Zablocki; Rico; Garland; Rogers; Williams; Schretzman; Rao; Bovy; Tjoeng; Lindmark; Toth; Zupec; McMackins; Adams; Miyano; Markos; Milton; Paulson; Herin; et al. Journal of Medicinal Chemistry, 1995 , vol. 38, # 13 p. 2378 - 2394
  • Route2

    References

    • Tasnadi, Gabor; Forro, Eniko; Fueloep, Ferenc Tetrahedron Asymmetry, 2008 , vol. 19, # 17 p. 2072 - 2077

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

Quality Control

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Computational Chemistry Data

  • TPSA   70.78
  • LogP   1.7901
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   4

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