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CS-W001157 4
Total: USD 88.00

3-Nitrophthalonitrile

  • CAS No. 51762-67-5

  • Cat. No. CS-W017559
  • Purity≥98%
  • MDL No.MFCD00191558

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

3-Nitrophthalonitrile|CS-W017559

Structure of 51762-67-5

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General Information

  • CAS No. 51762-67-5
  • Cat. No. CS-W017559
  • Purity ≥98%
  • MDL No. MFCD00191558
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₃N₃O₂
  • Molecular Weight 173.13
  • Synonym(s) 3-nitrobenzene-1,2-dicarbonitrile; 3-Nitrophthalonitrile
  • SMILES N#CC1=CC=CC([N+]([O-])=O)=C1C#N

Description

m-PEG8-(CH2)12-phosphonic acid ethyl ester is a PEG linker containing phosphonic acid ethyl ester. The hydrophilic PEG linker increases the water solubility properties of the compound.

Synthesis

  • Route1
    • 3-Nitrophthalamide|CS-0697721
      96385-50-1
    • ~85%
    • In-stock
      3-Nitrophthalonitrile|CS-W017559
      51762-67-5

    References

    • George, Robert D.; Snow, Arthur W. Journal of Heterocyclic Chemistry, 1995 , vol. 32, # 2 p. 495 - 498
  • Route2

    References

    • Peng, Xinhua; Fukui, Naoyuki; Mizuta, Masayuki; Suzuki, Hitomi Organic and Biomolecular Chemistry, 2003 , vol. 1, # 13 p. 2326 - 2335
  • Route3

    References

    • Oshima, Juro; Yoshihara, Toshitada; Tobita, Seiji Chemical Physics Letters, 2006 , vol. 423, # 4-6 p. 306 - 311

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362-P405-P501

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Computational Chemistry Data

  • TPSA   90.72
  • LogP   1.33816
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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