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CS-W001157 4
Total: USD 88.00

Ethyl 3-(4-bromophenyl)propanoate

  • CAS No. 40640-98-0

  • Cat. No. CS-W012554
  • Purity≥97%
  • MDL No.MFCD07772961

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

Ethyl 3-(4-bromophenyl)propanoate|CS-W012554

Structure of 40640-98-0

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General Information

  • CAS No. 40640-98-0
  • Cat. No. CS-W012554
  • Purity ≥97%
  • MDL No. MFCD07772961
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃BrO₂
  • Molecular Weight 257.13
  • Synonym(s) None
  • SMILES O=C(OCC)CCC1=CC=C(Br)C=C1

Description

Ethyl 3-(4-bromophenyl)propanoate is a bench-stable, moisture-tolerant building block featuring a para-brominated phenyl group linked via a β-phenylpropionate chain. This structure enables direct incorporation into Suzuki-Miyaura cross-coupling reactions and facilitates the synthesis of functionalized arylalkyl scaffolds in medicinal chemistry and materials science.

Application

Ethyl 3-(4-bromophenyl)propanoate serves as a versatile building block in synthetic organic chemistry, enabling palladium-catalyzed cross-coupling reactions due to its well-defined aryl bromide functionality. The ester group offers orthogonal reactivity for subsequent transformations, while the aliphatic chain provides structural flexibility for downstream applications. Bench-stable and readily purified by recrystallization or column chromatography, it facilitates efficient synthesis of complex pharmaceutical intermediates and functionalized heterocycles.

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.9448
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   4

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