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CS-W001157 4
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Methyl 2-(benzyloxy)-5-(2-bromoacetyl)benzoate

  • CAS No. 27475-14-5

  • Cat. No. CS-M1167
  • Molecule weight363.20
  • Purity≥98%
  • MDL No.MFCD08274752

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

Methyl 2-(benzyloxy)-5-(2-bromoacetyl)benzoate|CS-M1167

Structure of 27475-14-5

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General Information

  • CAS No. 27475-14-5
  • Cat. No. CS-M1167
  • Purity ≥98%
  • MDL No. MFCD08274752
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₁₅BrO₄
  • Molecular Weight 363.20
  • Synonym(s) Salmeterol Impurity 16
  • SMILES O=C(OC)C(C=C(C=C1)C(CBr)=O)=C1OCC2=CC=CC=C2

Synthesis

  • Route1
    • Methyl 5-acetyl-2-(benzyloxy)benzoate|CS-M1166
      27475-09-8
    • ~81%
    • Methyl 2-(benzyloxy)-5-(2-bromoacetyl)benzoate|CS-M1167
      27475-14-5

    References

    • CADILA HEALTHCARE LIMITED; DWIVEDI, Shriprakash, Dhar; SHAH, Niraj, Shyamlal Patent: WO2012/32546 A2, 2012 ; Location in patent: Page/Page column 25-26 ;
  • Route2

    References

    • Meglio, P. de; Carissimi, M.; Ravenna, F.; Gentili, P.; Manzardo, S. Farmaco, Edizione Scientifica, 1980 , vol. 35, # 3 p. 202 - 230
  • Route3
    • null|null
      100-44-7
    • ~%
    • Methyl 2-(benzyloxy)-5-(2-bromoacetyl)benzoate|CS-M1167
      27475-14-5

    References

    • CADILA HEALTHCARE LIMITED; DWIVEDI, Shriprakash, Dhar; SHAH, Niraj, Shyamlal Patent: WO2012/32546 A2, 2012 ;

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.6
  • LogP   3.6298
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   6

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