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CS-W001157 4
Total: USD 88.00

Methyl 3-bromopropanoate

  • CAS No. 3395-91-3

  • Cat. No. CS-W008728
  • Purity≥98%
  • MDL No.MFCD00000250

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

Methyl 3-bromopropanoate|CS-W008728

Structure of 3395-91-3

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General Information

  • CAS No. 3395-91-3
  • Cat. No. CS-W008728
  • Purity ≥98%
  • MDL No. MFCD00000250
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₇BrO₂
  • Molecular Weight 167.00
  • Synonym(s) None
  • SMILES O=C(OC)CCBr

Description

Methyl 3-bromopropionate was used in the synthesis of spiroanellated -lactones, pinacols and unprecedented 3-(1-hydroxycycloalkyl)-l-oxaspiro[n,m]alkan-2-ones.

Application

Methyl 3-bromopropanoate serves as a versatile alkylating agent in synthetic organic chemistry, enabling efficient C–C bond formation via nucleophilic substitution. Its bromide functionality facilitates conjugate addition and heterocycle construction, while the ester group offers compatibility with standard reaction conditions. Bench-stable and readily purified by distillation or chromatography, it functions effectively in multistep syntheses requiring selective functionalization.

Synthesis

  • Route1
    • null|null
      554-12-1
    • ~87%
    • In-stock
      Methyl 3-bromopropanoate|CS-W008728
      3395-91-3

    References

    • PHARMACIA and UPJOHN COMPANY Patent: WO2004/13137 A1, 2004 ; Location in patent: Page 76 ; WO 2004/013137 A1
  • Route2
    • null|null
      292638-85-8
    • ~97%
    • In-stock
      Methyl 3-bromopropanoate|CS-W008728
      3395-91-3

    References

    • Lee, Adam Shih-Yuan; Wang, Shu-Huei; Chang, Yu-Ting Journal of the Chinese Chemical Society, 2014 , vol. 61, # 3 p. 364 - 368
  • Route3
    • null|null
      590-92-1
    • null|null
      67-56-1
    • ~82%
    • In-stock
      Methyl 3-bromopropanoate|CS-W008728
      3395-91-3

    References

    • Dawadi, Prativa B. S.; Schulten, Els A. M.; Lugtenburg, Johan Journal of Labelled Compounds and Radiopharmaceuticals, 2009 , vol. 52, # 9 p. 341 - 349

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H227-H302-H315-H319-H335
Precautionary Statements : P210-P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P370+P378-P403-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   0.9444
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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