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CS-W001157 4
Total: USD 88.00

Methyl 5-bromo-2-methoxy-4-methylbenzoate

  • CAS No. 39503-58-7

  • Cat. No. CS-W020495
  • Purity≥97%
  • MDL No.MFCD11045603

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

Methyl 5-bromo-2-methoxy-4-methylbenzoate|CS-W020495

Structure of 39503-58-7

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General Information

  • CAS No. 39503-58-7
  • Cat. No. CS-W020495
  • Purity ≥97%
  • MDL No. MFCD11045603
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁BrO₃
  • Molecular Weight 259.10
  • Synonym(s) Benzoic acid, 5-?bromo-?2-?methoxy-?4-?methyl-?, methyl ester
  • SMILES COC(=O)c1cc(Br)c(C)cc1OC

Synthesis

  • Route1

    References

    • BOEHRINGER INGELHEIM INTERNATIONAL GMBH; BOEHRINGER INGELHEIM PHARMA GMBH and CO KG Patent: WO2004/108673 A2, 2004 ; Location in patent: Page 47-49 ;
  • Route2

    References

    • Julia,M.; Chastrette,F. Bulletin de la Societe Chimique de France, 1962 , p. 2255 - 2261
  • Route3
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      122-46-3
    • ~%
    • In-stock
      Methyl 5-bromo-2-methoxy-4-methylbenzoate|CS-W020495
      39503-58-7

    References

    • Julia,M.; Chastrette,F. Bulletin de la Societe Chimique de France, 1962 , p. 2255 - 2261

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

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Computational Chemistry Data

  • TPSA   35.53
  • LogP   2.55272
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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