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CS-W001157 4
Total: USD 88.00

Ethyl 3-Bromobutyrate

  • CAS No. 7425-49-2

  • Cat. No. CS-0197403
  • Purity≥97%
  • MDL No.None

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

Ethyl 3-Bromobutyrate|CS-0197403

Structure of 7425-49-2

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General Information

  • CAS No. 7425-49-2
  • Cat. No. CS-0197403
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₁BrO₂
  • Molecular Weight 195.05
  • Synonym(s) Ethyl3-Bromobutyrate
  • SMILES CCOC(=O)CC(C)Br

Description

Ethyl 3-bromobutyrate is a versatile alkylating agent featuring a bromine atom at the γ-position relative to the ester group. This configuration enables selective functionalization in synthetic sequences, particularly in Michael additions and nucleophilic substitutions. The molecule exhibits good stability under standard conditions and facilitates efficient carbon–carbon bond formation in complex molecule assembly.

Application

Ethyl 3-bromobutyrate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to substituted pyrrolidines and other nitrogen-containing heterocycles via cyclization reactions. Its α-bromo carbonyl functionality facilitates nucleophilic substitution and metal-catalyzed coupling processes with high functional group tolerance. The compound exhibits excellent bench stability and is readily purified by distillation or column chromatography, making it well-suited for iterative synthesis workflows in medicinal chemistry and process development.

Safety Information

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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

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   1.723
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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