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CS-W001157 4
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7-Benzyl-4-chloro-7H-pyrrolo[2,3-d] pyrimidine

  • CAS No. 16019-34-4

  • Cat. No. CS-0156310
  • Molecule weight243.69
  • Purity≥95%
  • MDL No.MFCD09953011

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

7-Benzyl-4-chloro-7H-pyrrolo[2,3-d] pyrimidine|CS-0156310

Structure of 16019-34-4

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General Information

  • CAS No. 16019-34-4
  • Cat. No. CS-0156310
  • Purity ≥95%
  • MDL No. MFCD09953011
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₀ClN₃
  • Molecular Weight 243.69
  • Synonym(s) 7-Benzyl-4-chloro-7H-pyrrolo[2,3-d]pyrimidine
  • SMILES C1=CC=C(C=C1)CN2C=CC3=C(Cl)N=CN=C32

Synthesis

  • Route1
    • null|null
      100-44-7
    • 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine Tofacitinib Impurity|CS-0213936
      3680-69-1
    • ~89%
    • In-stock
      7-Benzyl-4-chloro-7H-pyrrolo[2,3-d] pyrimidine|CS-0156310
      16019-34-4

    References

    • Journal of Medicinal Chemistry, , vol. 38, # 19 p. 3884 - 3888
  • Route2
    • null|null
      100-39-0
    • 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine Tofacitinib Impurity|CS-0213936
      3680-69-1
    • ~%
    • In-stock
      7-Benzyl-4-chloro-7H-pyrrolo[2,3-d] pyrimidine|CS-0156310
      16019-34-4

    References

    • Bioorganic and Medicinal Chemistry, , vol. 20, # 18 p. 5473 - 5482
  • Route3
    • 7-(Benzenesulfonyl)-4-chloro-7H-pyrrolo[2,3-d]pyrimidine|CS-0050136
      186519-89-1
    • In-stock
      Benzyl alcohol|CS-4355
      100-51-6
    • ~63%
    • In-stock
      7-Benzyl-4-chloro-7H-pyrrolo[2,3-d] pyrimidine|CS-0156310
      16019-34-4

    References

    • Tetrahedron Letters, , vol. 39, # 32 p. 5685 - 5688

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   30.71
  • LogP   3.133
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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