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CS-W001157 4
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Methyl 5-bromo-2-(difluoromethoxy)benzoate

  • CAS No. 1131587-78-4

  • Cat. No. CS-0041187
  • Molecule weight281.05
  • Purity≥96%
  • MDL No.MFCD11110847

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

Methyl 5-bromo-2-(difluoromethoxy)benzoate|CS-0041187

Structure of 1131587-78-4

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General Information

  • CAS No. 1131587-78-4
  • Cat. No. CS-0041187
  • Purity ≥96%
  • MDL No. MFCD11110847
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇BrF₂O₃
  • Molecular Weight 281.05
  • Synonym(s) None
  • SMILES O=C(OC)C1=CC(Br)=CC=C1OC(F)F

Synthesis

  • Route1

    References

    • INCEPTION 2, INC.; STOCK, Nicholas, Simon; CHEN, Austin, Chih-Yu; BRAVO, Yalda, Mostofi; JACINTHO, Jason, Duarte; SCOTT, Jill, Melissa; STEARNS, Brian, Andrew; CLARK, Ryan, Christopher; TRUONG, Yen, Pham Patent: WO2013/134562 A1, 2013 ; Location in patent: Paragraph 00294 ;

Safety Information

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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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   35.53
  • LogP   2.8371
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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