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CS-W001157 4
Total: USD 88.00

4-(4-Chlorophenyl)phthalazin-1(2H)-one

  • CAS No. 51334-86-2

  • Cat. No. CS-0090879
  • Purity≥98%
  • MDL No.None

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

4-(4-Chlorophenyl)phthalazin-1(2H)-one|CS-0090879

Structure of 51334-86-2

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General Information

  • CAS No. 51334-86-2
  • Cat. No. CS-0090879
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₉ClN₂O
  • Molecular Weight 256.69
  • Synonym(s) 4-(4-chlorophenyl)-1(2H)-phthalazinone
  • SMILES O=C1NN=C(C2=CC=C(Cl)C=C2)C3=C1C=CC=C3

Synthesis

  • Route1

    References

    • Yamaguchi; Kamei; Koga; Akima; Kuroki; Ohi Journal of Medicinal Chemistry, 1993 , vol. 36, # 25 p. 4052 - 4060
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      4-(4-Chlorophenyl)phthalazin-1(2H)-one|CS-0090879
      51334-86-2

    References

    • Nguyen, Hanh Nho; Cee, Victor J.; Deak, Holly L.; Du, Bingfan; Faber, Kathleen Panter; Gunaydin, Hakan; Hodous, Brian L.; Hollis, Steven L.; Krolikowski, Paul H.; Olivieri, Philip R.; Patel, Vinod F.; Romero, Karina; Schenkel, Laurie B.; Geuns-Meyer, Stephanie D. Journal of Organic Chemistry, 2012 , vol. 77, # 8 p. 3887 - 3906

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
Precautionary Statements : P264-P270-P280-P302+P352-P305+P351+P338-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   45.75
  • LogP   3.2435
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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