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CS-W001157 4
Total: USD 88.00

5-(4-Bromophenyl)isoxazole-3-carbaldehyde

  • CAS No. 640292-04-2

  • Cat. No. CS-W009467
  • Molecule weight252.07
  • Purity≥96%
  • MDL No.MFCD06199346

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

5-(4-Bromophenyl)isoxazole-3-carbaldehyde|CS-W009467

Structure of 640292-04-2

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General Information

  • CAS No. 640292-04-2
  • Cat. No. CS-W009467
  • Purity ≥96%
  • MDL No. MFCD06199346
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₆BrNO₂
  • Molecular Weight 252.07
  • Synonym(s) OTAVA-BB 1150845
  • SMILES BrC1=CC=C(C=C1)C1=CC(C=O)=NO1

Synthesis

  • Route1
    • (5-(4-Bromophenyl)isoxazol-3-yl)methanol|CS-0089008
      640291-96-9
    • ~%
    • 5-(4-Bromophenyl)isoxazole-3-carbaldehyde|CS-W009467
      640292-04-2

    References

    • Roy, Amrendra K.; Batra, Sanjay Synthesis, 2003 , # 15 p. 2325 - 2330
  • Route2
    • Ethyl 4-(4-bromophenyl)-2,4-dioxobutanoate|CS-0122071
      40155-54-2
    • ~%
    • 5-(4-Bromophenyl)isoxazole-3-carbaldehyde|CS-W009467
      640292-04-2

    References

    • Roy, Amrendra K.; Batra, Sanjay Synthesis, 2003 , # 15 p. 2325 - 2330
  • Route3

    References

    • Roy, Amrendra K.; Batra, Sanjay Synthesis, 2003 , # 15 p. 2325 - 2330

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   43.1
  • LogP   2.9166
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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