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CS-W001157 4
Total: USD 88.00

2,4,5-Trichloro-6-hydroxybenzene-1,3-dicarbonitrile

  • CAS No. 28343-61-5

  • Cat. No. CS-0252299
  • Molecule weight247.47
  • Purity≥95%
  • MDL No.MFCD00152214

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

2,4,5-Trichloro-6-hydroxybenzene-1,3-dicarbonitrile|CS-0252299

Structure of 28343-61-5

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General Information

  • CAS No. 28343-61-5
  • Cat. No. CS-0252299
  • Purity ≥95%
  • MDL No. MFCD00152214
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈HCl₃N₂O
  • Molecular Weight 247.47
  • Synonym(s) 4-Hydroxy-2,5,6-trichloroisophthalonitrile
  • SMILES C(#N)C1=C(C(=C(C(=C1Cl)Cl)O)C#N)Cl

Synthesis

  • Route1

    References

    • Rouchaud, Jean; Roucourt, Pascal; Metsue, Marc; Herin, Marc; Moulart, Claude Bulletin des Societes Chimiques Belges, 1989 , vol. 98, # 3 p. 211 - 214
  • Route2

    References

    • Heilman; Battershell; Pyne; Goble; Magee Journal of Medicinal Chemistry, 1978 , vol. 21, # 9 p. 906 - 913
  • Route3

    References

    • Rouchaud, Jean; Roucourt, Pascal; Metsue, Marc; Herin, Marc; Moulart, Claude Bulletin des Societes Chimiques Belges, 1989 , vol. 98, # 3 p. 211 - 214

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅱ
Hazard Statements : H317-H318-H330-H335-H351-H410
Precautionary Statements : P260-P261-P271-P272-P273-P280-P284-P302+P352-P304+P340-P362+P364-P391-P405-P501

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Computational Chemistry Data

  • TPSA   67.81
  • LogP   3.09576
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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