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CS-W001157 4
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4-(tert-Butyl)-2-hydroxybenzaldehyde

  • CAS No. 66232-34-6

  • Cat. No. CS-0106379
  • Molecule weight178.23
  • Purity≥98%
  • MDL No.MFCD06412558

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

4-(tert-Butyl)-2-hydroxybenzaldehyde|CS-0106379

Structure of 66232-34-6

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General Information

  • CAS No. 66232-34-6
  • Cat. No. CS-0106379
  • Purity ≥98%
  • MDL No. MFCD06412558
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄O₂
  • Molecular Weight 178.23
  • Synonym(s) 4-tert-Butylsalicylaldehyde
  • SMILES OC1=CC(C(C)(C)C)=CC=C1C=O

Description

4-(tert-Butyl)-2-hydroxybenzaldehyde features a sterically shielded tert-butyl group and a phenolic hydroxyl, enhancing stability and solubility in organic media. This electron-rich aldehyde integrates readily into synthesis pathways requiring robust, bench-stable aromatic building blocks.

Application

4-(tert-Butyl)-2-hydroxybenzaldehyde serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling efficient access to substituted phenolic scaffolds. Its ortho-hydroxyl group facilitates chelation-assisted transformations, while the sterically hindered tert-butyl substituent enhances stability and modulates electronic properties. The aldehyde functionality permits straightforward derivatization via condensation, reductive amination, or Grignard addition, offering robust utility in multi-step syntheses.

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   37.3
  • LogP   2.5022
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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