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CS-W001157 4
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Methyl2-(4-aminophenyl)acetatehydrochloride

  • CAS No. 83528-16-9

  • Cat. No. CS-0172520
  • Purity≥96%
  • MDL No.None

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

Methyl2-(4-aminophenyl)acetatehydrochloride|CS-0172520

Structure of 83528-16-9

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General Information

  • CAS No. 83528-16-9
  • Cat. No. CS-0172520
  • Purity ≥96%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂ClNO₂
  • Molecular Weight 201.65
  • Synonym(s) Methyl 2-(4-aminophenyl)acetate hydrochloride
  • SMILES COC(=O)CC1=CC=C(C=C1)N.Cl

Synthesis

  • Route1

    References

    • Karl Thomae Patent: US5994356 A1, 1999 ;
  • Route2

    References

    • Kannan Sivaraman, Komagal; Paiardini, Alessandro; Sienczyk, Marcin; Ruggeri, Chiara; Oellig, Christine A.; Dalton, John P.; Scammells, Peter J.; Drag, Marcin; McGowan, Sheena Journal of Medicinal Chemistry, 2013 , vol. 56, # 12 p. 5213 - 5217
  • Route3

    References

    • AtraZeneca AB Patent: US2004/101864 A1, 2004 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   52.32
  • LogP   1.4061
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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