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CS-W001157 4
Total: USD 88.00

2-(2-(4-Fluorophenyl)-2-oxoethyl)malononitrile

  • CAS No. 748810-25-5

  • Cat. No. CS-0571250
  • Purity≥98%
  • MDL No.None

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

2-(2-(4-Fluorophenyl)-2-oxoethyl)malononitrile|CS-0571250

Structure of 748810-25-5

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General Information

  • CAS No. 748810-25-5
  • Cat. No. CS-0571250
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₇FN₂O
  • Molecular Weight 202.18
  • Synonym(s) Vonoprazan-033
  • SMILES C1=CC(=CC=C1C(=O)CC(C#N)C#N)F

Synthesis

  • Route1

    References

    • Mohammed, Khalid; Hilmy, Hassan Archiv der Pharmazie, 2004 , vol. 337, # 1 p. 15 - 19

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-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   64.65
  • LogP   2.06186
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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