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CS-W001157 4
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4-(2-Hydroxypropan-2-yl)benzaldehyde

  • CAS No. 81036-81-9

  • Cat. No. CS-0469216
  • Molecule weight164.20
  • Purity≥98%
  • MDL No.None

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

4-(2-Hydroxypropan-2-yl)benzaldehyde|CS-0469216

Structure of 81036-81-9

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General Information

  • CAS No. 81036-81-9
  • Cat. No. CS-0469216
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂O₂
  • Molecular Weight 164.20
  • Synonym(s) p-formylcumyl alcohol
  • SMILES O=CC1=CC=C(C(C)(O)C)C=C1

Description

This bench-stable aldehyde features a para-hydroxyisopropyl substituent that enhances solubility and modulates electronic effects. The hydroxyl group enables hydrogen bonding, facilitating integration into complex synthetic sequences. This structural motif supports efficient coupling reactions under mild conditions.

Application

4-(2-Hydroxypropan-2-yl)benzaldehyde serves as a stable, bench-ready aromatic aldehyde with a sterically hindered tertiary alcohol group. Its functionality enables direct use in condensation reactions, including Mannich and Schiff base formations, without requiring protection. The hydroxyl group enhances solubility in polar solvents and contributes to favorable handling characteristics during synthesis of functionalized benzene derivatives and heterocyclic scaffolds.

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   37.3
  • LogP   1.7265
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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