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CS-W001157 4
Total: USD 88.00

Ethyl 2-amino-4-bromobenzoate

  • CAS No. 117323-99-6

  • Cat. No. CS-0210001
  • Purity≥98%
  • MDL No.MFCD11042864

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

Ethyl 2-amino-4-bromobenzoate|CS-0210001

Structure of 117323-99-6

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General Information

  • CAS No. 117323-99-6
  • Cat. No. CS-0210001
  • Purity ≥98%
  • MDL No. MFCD11042864
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀BrNO₂
  • Molecular Weight 244.09
  • Synonym(s) Benzoic acid, 2-amino-4-bromo-, ethyl ester
  • SMILES CCOC(=O)C1=C(C=C(C=C1)Br)N

Synthesis

  • Route1
    • 4-Bromo-2-acetamidobenzoic acid|CS-0208190
      101861-53-4
    • ~20%
    • Ethyl 2-amino-4-bromobenzoate|CS-0210001
      117323-99-6

    References

    • Pfizer Inc. Patent: US4762838 A1, 1988 ;
  • Route2

    References

    • Pfizer Inc. Patent: US4762838 A1, 1988 ;
  • Route3

    References

    • DANA-FARBER CANCER INSTITUTE, INC.; WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH; BRADNER, James, E.; MCKEOWN, Michael, R.; RAHL, Peter, B.; YOUNG, Richard, A.; MARINEAU, Jason, J. Patent: WO2014/71247 A1, 2014 ; Location in patent: Paragraph 00332 ;

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   52.32
  • LogP   2.208
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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