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CS-W001157 4
Total: USD 88.00

Aripiprazole impurity 1

  • CAS No. 120004-79-7

  • Cat. No. CS-0036678
  • Molecule weight253.73
  • Purity≥97%
  • MDL No.MFCD07787529

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

Aripiprazole impurity 1|CS-0036678

Structure of 120004-79-7

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General Information

  • CAS No. 120004-79-7
  • Cat. No. CS-0036678
  • Purity ≥97%
  • MDL No. MFCD07787529
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₆ClNO₂
  • Molecular Weight 253.73
  • Synonym(s) None
  • SMILES C(CCOC1=CC2=C(C=C1)CCC(=N2)O)CCl

Synthesis

  • Route1
    • In-stock
      1-Bromo-4-chlorobutane|CS-W017647
      6940-78-9
    • 7-Hydroxy-3,4-dihydroquinolin-2(1H)-one  Brexpiprazole Impurity|CS-0167116
      22246-18-0
    • ~92%
    • In-stock
      Aripiprazole impurity 1|CS-0036678
      120004-79-7

    References

    • UNICHEM LABORATORIES LIMITED Patent: WO2007/94009 A1, 2007 ; Location in patent: Page/Page column 7 ;
  • Route2
    • 7-Hydroxy-3,4-dihydroquinolin-2(1H)-one  Brexpiprazole Impurity|CS-0167116
      22246-18-0
    • null|null
      110-56-5
    • ~91%
    • In-stock
      Aripiprazole impurity 1|CS-0036678
      120004-79-7

    References

    • Naddaka, Vladimir; Brand, Michael; Davidi, Guy; Klopfer, Eyal; Gribun, Irina; Arad, Oded; Kaspi, Joseph Patent: US2006/79689 A1, 2006 ; Location in patent: Page/Page column 9; 10 ;
  • Route3
    • In-stock
      1-Bromo-4-chlorobutane|CS-W017647
      6940-78-9
    • 7-Hydroxy-3,4-dihydroquinolin-2(1H)-one  Brexpiprazole Impurity|CS-0167116
      22246-18-0
    • ~%
    • In-stock
      Aripiprazole impurity 1|CS-0036678
      120004-79-7
    • Aripiprazole impurity 37|CS-0229516
      129722-34-5

    References

    • WO2007/118923 A1, ; Page/Page column 7-8 ;

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

Quality Control

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Computational Chemistry Data

  • TPSA   41.82
  • LogP   3.6186
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   5

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