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CS-W001157 4
Total: USD 88.00

Methyl 4-bromocrotonate

  • CAS No. 1117-71-1

  • Cat. No. CS-W008761
  • Purity≥80%
  • MDL No.MFCD00000246

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

Methyl 4-bromocrotonate|CS-W008761

Structure of 1117-71-1

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General Information

  • CAS No. 1117-71-1
  • Cat. No. CS-W008761
  • Purity ≥80%
  • MDL No. MFCD00000246
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₇BrO₂
  • Molecular Weight 179.01
  • Synonym(s) Methyl bromo crotonate
  • SMILES O=C(OC)/C=C/CBr

Synthesis

  • Route1
    • null|null
      623-43-8
    • ~79%
    • In-stock
      Methyl 4-bromocrotonate|CS-W008761
      1117-71-1

    References

    • Houllemare, Didier; Outurquin, Francis; Paulmier, Claude Journal of the Chemical Society - Perkin Transactions 1, 1997 , # 11 p. 1629 - 1632
  • Route2
    • null|null
      3724-65-0
    • ~%
    • In-stock
      Methyl 4-bromocrotonate|CS-W008761
      1117-71-1

    References

    • Pullin, Robert D. C.; Rathi, Akshat H.; Melikhova, Ekaterina Y.; Winter, Christian; Thompson, Amber L.; Donohoe, Timothy J. Organic Letters, 2013 , vol. 15, # 21 p. 5492 - 5495
  • Route3
    • null|null
      623-43-8
    • ~%
    • In-stock
      Methyl 4-bromocrotonate|CS-W008761
      1117-71-1
    • (Z)-Methyl 4-bromobut-2-enoate|CS-0369102
      56699-18-4

    References

    • Organic Letters, , vol. 16, # 5 p. 1438 - 1441

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3334
Class : 9
Packing Group : Ⅲ
Hazard Statements : H227-H315-H318-H335
Precautionary Statements : P210-P261-P264-P271-P280-P302+P352-P304+P340-P362-P370+P378-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   1.1105
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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