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2,2'-(5-(Chloromethyl)-1,3-phenylene)bis(2-methylpropanenitrile) Anastrozole Impurity

  • CAS No. 120511-91-3

  • Cat. No. CS-0179352
  • Purity≥97%
  • MDL No.None

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

2,2'-(5-(Chloromethyl)-1,3-phenylene)bis(2-methylpropanenitrile) Anastrozole Impurity|CS-0179352

Structure of 120511-91-3

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General Information

  • CAS No. 120511-91-3
  • Cat. No. CS-0179352
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₇ClN₂
  • Molecular Weight 260.76
  • Synonym(s) Anastrozole EP Impurity I
  • SMILES N#CC(C)(C)C1=CC(CCl)=CC(C(C)(C)C#N)=C1

Synthesis

  • Route1

    References

    • Pis, Jaroslav; Smrz, Rudolf Patent: US2007/281982 A1, 2007 ; Location in patent: Page/Page column 6 ;

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-H312-H315-H319-H332
Precautionary Statements : P261-P264-P270-P271-P280-P301+P310-P302+P352-P304+P341-P305+P351+P338-P312-P330-P332+P313-P337+P313-P362+P364-P363-P501

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Computational Chemistry Data

  • TPSA   47.58
  • LogP   4.02776
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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