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CS-W001157 4
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Ethyl 4-(bromomethyl)benzoate

  • CAS No. 26496-94-6

  • Cat. No. CS-0151759
  • Purity≥98%
  • MDL No.MFCD03791307

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

Ethyl 4-(bromomethyl)benzoate|CS-0151759

Structure of 26496-94-6

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General Information

  • CAS No. 26496-94-6
  • Cat. No. CS-0151759
  • Purity ≥98%
  • MDL No. MFCD03791307
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁BrO₂
  • Molecular Weight 243.10
  • Synonym(s) 4-(Bromomethyl)benzoic acid ethyl ester~4-Ethoxycarbonylbenzyl bromide
  • SMILES CCOC(=O)C1=CC=C(C=C1)CBr

Description

Ethyl 4-(bromomethyl)benzoate features a bromomethyl group appended to the para position of an ethyl benzoate scaffold. This reactive handle enables direct functionalization in nucleophilic substitution reactions, facilitating the integration of complex aryl motifs into synthetic architectures under mild conditions.

Application

Ethyl 4-(bromomethyl)benzoate serves as a versatile synthetic intermediate for constructing biaryl and heterocyclic architectures. The bromomethyl group enables reliable nucleophilic substitution, enabling efficient coupling with amines, thiols, and carbon nucleophiles under mild conditions. Its bench-stable nature and compatibility with common protecting groups facilitate straightforward purification and integration into multi-step syntheses. Functions effectively in the preparation of pharmaceutical scaffolds and functionalized aromatic compounds.

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS09
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅱ
Hazard Statements : H314-H410
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.7582
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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