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CS-W001157 4
Total: USD 88.00

1-Acetyl-5-bromo-1H-indol-3-yl acetate

  • CAS No. 33588-54-4

  • Cat. No. CS-W014548
  • Purity≥98%
  • MDL No.MFCD00005799

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

1-Acetyl-5-bromo-1H-indol-3-yl acetate|CS-W014548

Structure of 33588-54-4

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General Information

  • CAS No. 33588-54-4
  • Cat. No. CS-W014548
  • Purity ≥98%
  • MDL No. MFCD00005799
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₀BrNO₃
  • Molecular Weight 296.12
  • Synonym(s) N-acetyl-5-bromoindolyl acetate
  • SMILES CC(OC1=CN(C(C)=O)C2=C1C=C(Br)C=C2)=O

Synthesis

  • Route1
    • 5-Bromo-2-((carboxymethyl)amino)benzoic acid|CS-0367152
      32253-75-1
    • null|null
      108-24-7
    • ~66%
    • In-stock
      1-Acetyl-5-bromo-1H-indol-3-yl acetate|CS-W014548
      33588-54-4

    References

    • Guyen, Berangere; Schultes, Christoph M.; Hazel, Pascale; Mann, John; Neidle, Stephen Organic and Biomolecular Chemistry, 2004 , vol. 2, # 7 p. 981 - 988
  • Route2
    • 5-Bromo-2-((carboxymethyl)amino)benzoic acid|CS-0367152
      32253-75-1
    • ~%
    • In-stock
      1-Acetyl-5-bromo-1H-indol-3-yl acetate|CS-W014548
      33588-54-4

    References

    • Journal of Medicinal Chemistry, , vol. 48, # 7 p. 2701 - 2709
  • Route3

    References

    • Journal of Medicinal Chemistry, , vol. 48, # 7 p. 2701 - 2709

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

Quality Control

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Computational Chemistry Data

  • TPSA   48.3
  • LogP   2.9892
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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