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CS-W001157 4
Total: USD 88.00

2-((6-Chloropyrimidin-4-yl)oxy)benzonitrile

  • CAS No. 913846-53-4

  • Cat. No. CS-0171185
  • Purity≥97%
  • MDL No.None

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

2-((6-Chloropyrimidin-4-yl)oxy)benzonitrile|CS-0171185

Structure of 913846-53-4

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General Information

  • CAS No. 913846-53-4
  • Cat. No. CS-0171185
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₆ClN₃O
  • Molecular Weight 231.64
  • Synonym(s) 4-CHLORO-6-(2-CYANOPHENOXY)-PYRIMIDINE
  • SMILES C1=CC=C(C(=C1)C#N)OC2=NC=NC(=C2)Cl

Synthesis

  • Route1

    References

    • Augeri, David J.; Carlsen, Marianne; Carson, Kenneth G.; Fu, Qinghong; Healy, Jason P.; Heim-Riether, Alexander; Jessop, Theodore C.; Keyes, Philip E.; Shen, Min; Tarver, James E.; Taylor, Jerry A.; Xu, Xiaolian Patent: US2008/146571 A1, 2008 ; Location in patent: Page/Page column 9-10 ;

Safety Information

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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   58.8
  • LogP   2.79398
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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