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CS-W001157 4
Total: USD 88.00

2,4-Dihydroxy-5-isopropylbenzoic acid

  • CAS No. 1184181-48-3

  • Cat. No. CS-0106616
  • Purity≥98%
  • MDL No.MFCD16996083

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

2,4-Dihydroxy-5-isopropylbenzoic acid|CS-0106616

Structure of 1184181-48-3

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General Information

  • CAS No. 1184181-48-3
  • Cat. No. CS-0106616
  • Purity ≥98%
  • MDL No. MFCD16996083
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂O₄
  • Molecular Weight 196.20
  • Synonym(s) 2,4-DIHYDROXY-5-(PROPAN-2-YL)BENZOIC ACID
  • SMILES O=C(O)C1=C(O)C=C(O)C(C(C)C)=C1

Description

This bench-stable dihydroxybenzoic acid derivative features a sterically hindered isopropyl group that enhances solubility and stability in aqueous and organic media. The ortho-hydroxyls enable chelation and hydrogen bonding, while the carboxylic acid facilitates conjugation and derivatization. Ideal for synthetic intermediates in pharmaceutical and agrochemical development.

Application

2,4-Dihydroxy-5-isopropylbenzoic acid serves as a versatile building block in the synthesis of bioactive heterocycles and functionalized aromatic scaffolds. Its ortho-dihydroxy motif enables chelation and metal-catalyzed coupling reactions, while the isopropyl group provides steric bulk and lipophilicity advantageous for medicinal chemistry optimization. The carboxylic acid functionality facilitates direct derivatization or salt formation, enhancing solubility and handling. Bench-stable and compatible with standard purification methods, it functions reliably in multi-step synthetic sequences requiring selective functionalization.

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   77.76
  • LogP   1.9194
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   2

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