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CS-W001157 4
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8-(tert-Butoxy)-8-oxooctanoic acid

  • CAS No. 234081-94-8

  • Cat. No. CS-0130044
  • Purity≥98%
  • MDL No.MFCD28505597

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

8-(tert-Butoxy)-8-oxooctanoic acid|CS-0130044

Structure of 234081-94-8

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General Information

  • CAS No. 234081-94-8
  • Cat. No. CS-0130044
  • Purity ≥98%
  • MDL No. MFCD28505597
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₂O₄
  • Molecular Weight 230.30
  • Synonym(s) None
  • SMILES O=C(O)CCCCCCC(=O)OC(C)(C)C

Description

This tert-butyl ester of oxooctanoic acid features a hydrolytically stable, bulky tert-butoxy group that enhances solubility and facilitates purification. The pendant ketone enables downstream functionalization in synthetic routes, while the carboxylic acid handle supports conjugation or derivatization under standard conditions.

Application

8-(tert-Butoxy)-8-oxooctanoic acid serves as a versatile β-keto ester surrogate, enabling efficient aldol and Michael additions under mild conditions. Its tert-butoxy carbonyl group provides enhanced bench stability and facilitates straightforward deprotection to the corresponding carboxylic acid. The molecule functions as a key building block in the synthesis of complex carbocycles and heterocyclic scaffolds, offering excellent functional group tolerance and compatibility with standard synthetic protocols.

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

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Computational Chemistry Data

  • TPSA   63.6
  • LogP   2.7533
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   7

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