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CS-W001157 4
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1-(3-Bromopropyl)pyrimidine-2,4(1H,3H)-dione

  • CAS No. 22917-77-7

  • Cat. No. CS-0553597
  • Molecule weight233.06
  • Purity≥98%
  • MDL No.None

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

1-(3-Bromopropyl)pyrimidine-2,4(1H,3H)-dione|CS-0553597

Structure of 22917-77-7

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General Information

  • CAS No. 22917-77-7
  • Cat. No. CS-0553597
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉BrN₂O₂
  • Molecular Weight 233.06
  • Synonym(s) 3-(1-Uracilyl)propyl bromide
  • SMILES C1=CN(C(=O)NC1=O)CCCBr

Synthesis

  • Route1

    References

    • Cui, Huaqing; Ruda, Gian Filippo; Carrero-Lerida, Juana; Ruiz-Perez, Luis M.; Gilbert, Ian H.; Gonzalez-Pacanowska, Dolores European Journal of Medicinal Chemistry, 2010 , vol. 45, # 11 p. 5140 - 5149
  • Route2

    References

    • Itahara, Toshio Bulletin of the Chemical Society of Japan, 1997 , vol. 70, # 9 p. 2239 - 2247
  • Route3
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    • 1-(3-Bromopropyl)pyrimidine-2,4(1H,3H)-dione|CS-0553597
      22917-77-7

    References

    • Dezor-Mazur, Maria; Koraniak, Henryk; Langer, Jerzy J.; Golankiewicz, Krzysztof Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1989 , p. 1209 - 1212

Safety Information

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GHS Pictogram :
GHS No : GHS06,GHS08
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331-H341
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   54.86
  • LogP   0.3216
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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