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CS-W001157 4
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4-(4-Bromo-phenoxy)-benzoic acid methyl ester

  • CAS No. 21120-75-2

  • Cat. No. CS-0213086
  • Molecule weight307.14
  • Purity≥95%
  • MDL No.MFCD09030697

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

4-(4-Bromo-phenoxy)-benzoic acid methyl ester|CS-0213086

Structure of 21120-75-2

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General Information

  • CAS No. 21120-75-2
  • Cat. No. CS-0213086
  • Purity ≥95%
  • MDL No. MFCD09030697
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₁BrO₃
  • Molecular Weight 307.14
  • Synonym(s) Methyl 4-(4-Bromophenoxy)benzoate
  • SMILES COC(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)Br

Synthesis

  • Route1

    References

    • Savi, Chris De; Morley, Andrew D.; Ting, Attilla; Nash, Ian; Karabelas, Kostas; Wood, Christine M.; James, Michael; Norris, Stephen J.; Karoutchi, Galith; Rankine, Neil; Hamlin, Gordon; MacFaul, Philip A.; Ryan, David; Baker, Sarah V.; Hargreaves, David; Gerhardt, Stefan Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 14 p. 4215 - 4219
  • Route2

    References

    • Stetter; Duve Chemische Berichte, 1954 , vol. 87, p. 1699,1703
  • Route3

    References

    • Stetter; Duve Chemische Berichte, 1954 , vol. 87, p. 1699,1703

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 : H317
Precautionary Statements : P261-P272-P280-P302+P352-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   35.53
  • LogP   4.028
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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