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CS-W001157 4
Total: USD 88.00

4-((2-Cyanopropan-2-yl)amino)-2-fluoro-N-methylbenzamide

  • CAS No. 915087-32-0

  • Cat. No. CS-B0040
  • Purity≥98%
  • MDL No.MFCD09909373

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

4-((2-Cyanopropan-2-yl)amino)-2-fluoro-N-methylbenzamide|CS-B0040

Structure of 915087-32-0

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General Information

  • CAS No. 915087-32-0
  • Cat. No. CS-B0040
  • Purity ≥98%
  • MDL No. MFCD09909373
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₄FN₃O
  • Molecular Weight 235.26
  • Synonym(s) None
  • SMILES N#CC(C)(C)NC1=CC(F)=C(C=C1)C(NC)=O

Synthesis

  • Route1
    • In-stock
      4-Amino-2-fluoro-N-methylbenzamide|CS-M1520
      915087-25-1
    • null|null
      75-86-5
    • ~74%
    • In-stock
      4-((2-Cyanopropan-2-yl)amino)-2-fluoro-N-methylbenzamide|CS-B0040
      915087-32-0

    References

    • Jung, Michael E.; Ouk, Samedy; Yoo, Dongwon; Sawyers, Charles L.; Chen, Charlie; Tran, Chris; Wongvipat, John Journal of Medicinal Chemistry, 2010 , vol. 53, # 7 p. 2779 - 2796
  • Route2
    • In-stock
      4-Amino-2-fluoro-N-methylbenzamide|CS-M1520
      915087-25-1
    • null|null
      7677-24-9
    • null|null
      67-64-1
    • ~78%
    • In-stock
      4-((2-Cyanopropan-2-yl)amino)-2-fluoro-N-methylbenzamide|CS-B0040
      915087-32-0

    References

    • TONG, Youzhi Patent: WO2011/29392 A1, 2011 ; Location in patent: Page/Page column 69 ; WO 2011/029392 A1
  • Route3

    References

    • TONG, Youzhi Patent: WO2011/29392 A1, 2011 ; WO 2011/029392 A1

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
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   64.92
  • LogP   1.89938
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   3

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