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CS-W001157 4
Total: USD 88.00

5-Bromo-6-methylpyrimidine-4-carbonitrile

  • CAS No. 114969-85-6

  • Cat. No. CS-0451783
  • Purity≥98%
  • MDL No.None

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

5-Bromo-6-methylpyrimidine-4-carbonitrile|CS-0451783

Structure of 114969-85-6

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General Information

  • CAS No. 114969-85-6
  • Cat. No. CS-0451783
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₄BrN₃
  • Molecular Weight 198.02
  • Synonym(s) 4-Pyrimidinecarbonitrile,5-bromo-6-methyl
  • SMILES CC1=C(C(=NC=N1)C#N)Br

Synthesis

  • Route1
    • null|null
      7677-24-9
    • null|null
      114969-56-1
    • ~72%
    • 5-Bromo-4-methylpyrimidine-2-carbonitrile|CS-0887868
      114969-80-1
    • 5-Bromo-6-methylpyrimidine-4-carbonitrile|CS-0451783
      114969-85-6

    References

    • Yamanaka, Hiroshi; Sakamoto, Takao; Nishimura, Sumiko; Sagi, Mataichi Chemical and Pharmaceutical Bulletin, 1987 , vol. 35, # 8 p. 3119 - 3126
  • Route2

    References

    • Yamanaka, Hiroshi; Sakamoto, Takao; Nishimura, Sumiko; Sagi, Mataichi Chemical and Pharmaceutical Bulletin, 1987 , vol. 35, # 8 p. 3119 - 3126
  • Route3

    References

    • Yamanaka, Hiroshi; Sakamoto, Takao; Nishimura, Sumiko; Sagi, Mataichi Chemical and Pharmaceutical Bulletin, 1987 , vol. 35, # 8 p. 3119 - 3126

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-H312-H315-H319-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   49.57
  • LogP   1.4192
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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