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CS-W001157 4
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Methyl 2-cyano-4-fluoro-6-methylbenzoate

  • CAS No. 877151-43-4

  • Cat. No. CS-0153716
  • Molecule weight193.17
  • Purity≥98%
  • MDL No.None

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

Methyl 2-cyano-4-fluoro-6-methylbenzoate|CS-0153716

Structure of 877151-43-4

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General Information

  • CAS No. 877151-43-4
  • Cat. No. CS-0153716
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈FNO₂
  • Molecular Weight 193.17
  • Synonym(s) 2-Cyano-4-fluoro-6-Methyl-benzoic acid Methyl ester
  • SMILES CC1=C(C(=CC(=C1)F)C#N)C(=O)OC

Synthesis

  • Route1

    References

    • NERVIANO MEDICAL SCIENCES S.R.L.; PAPEO, Gianluca Mariano Enrico; KRASAVIN, Mikhail Yurievitch; ORSINI, Paolo; SCOLARO, Alessandra Patent: WO2014/64149 A1, 2014 ;
  • Route2
    • 2-Bromo-4-fluoro-6-methylbenzamide|CS-1209960
      1262396-02-0
    • ~%
    • In-stock
      Methyl 2-cyano-4-fluoro-6-methylbenzoate|CS-0153716
      877151-43-4

    References

    • NERVIANO MEDICAL SCIENCES S.R.L.; PAPEO, Gianluca Mariano Enrico; KRASAVIN, Mikhail Yurievitch; ORSINI, Paolo; SCOLARO, Alessandra Patent: WO2014/64149 A1, 2014 ;
  • Route3

    References

    • NERVIANO MEDICAL SCIENCES S.R.L.; PAPEO, Gianluca Mariano Enrico; KRASAVIN, Mikhail Yurievitch; ORSINI, Paolo; SCOLARO, Alessandra Patent: WO2014/64149 A1, 2014 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   50.09
  • LogP   1.7924
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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