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CS-W001157 4
Total: USD 88.00

4-Methoxypyrimidine-2-carbonitrile

  • CAS No. 94789-37-4

  • Cat. No. CS-0050814
  • Molecule weight135.12
  • Purity98+%
  • MDL No.None

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

4-Methoxypyrimidine-2-carbonitrile|CS-0050814

Structure of 94789-37-4

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General Information

  • CAS No. 94789-37-4
  • Cat. No. CS-0050814
  • Purity 98+%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₅N₃O
  • Molecular Weight 135.12
  • Synonym(s) 2-Pyrimidinecarbonitrile, 4-methoxy- (6CI,9CI)
  • SMILES COC1=CC=NC(=N1)C#N

Synthesis

  • Route1

    References

    • COMENTIS, INC.; PURDUE RESEARCH FOUNDATION Patent: WO2009/42694 A1, 2009 ; Location in patent: Page/Page column 83 ; WO 2009/042694 A1
  • Route2
    • null|null
      7677-24-9
    • null|null
      17758-55-3
    • ~85%
    • 4-Methoxypyrimidine-2-carbonitrile|CS-0050814
      94789-37-4

    References

    • Yamanaka, Hiroshi; Nishimura, Sumiko; Kaneda, Soh-ichi; Sakamoto, Takao Synthesis, 1984 , # 8 p. 681 - 683

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361+P364-P405-P501

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Computational Chemistry Data

  • TPSA   58.8
  • LogP   0.35688
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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