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CS-W001157 4
Total: USD 88.00

2-Isopropyl-6-methylaniline

  • CAS No. 5266-85-3

  • Cat. No. CS-W020539
  • Purity≥96%
  • MDL No.MFCD00007746

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

2-Isopropyl-6-methylaniline|CS-W020539

Structure of 5266-85-3

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General Information

  • CAS No. 5266-85-3
  • Cat. No. CS-W020539
  • Purity ≥96%
  • MDL No. MFCD00007746
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₅N
  • Molecular Weight 149.23
  • Synonym(s) 6-Isopropyl-o-toluidine
  • SMILES NC1=C(C(C)C)C=CC=C1C

Description

2-Isopropyl-6-methylaniline delivers a sterically hindered aryl amine scaffold with enhanced solubility and thermal stability. This ortho-substituted aniline features a para-directing methyl group and an isopropyl moiety that imparts electronic modulation, enabling efficient coupling in cross-coupling reactions and facilitating incorporation into functionalized aromatic systems under standard conditions.

Application

2-Isopropyl-6-methylaniline serves as a valuable aryl amine building block in medicinal chemistry and agrochemical synthesis, offering enhanced lipophilicity and steric bulk compared to simpler anilines. Its ortho-substituted structure provides improved metabolic stability and facilitates selective functionalization in late-stage derivatization. The compound exhibits excellent bench stability and is compatible with standard coupling reactions, enabling efficient access to diverse heterocyclic scaffolds and API intermediates.

Safety Information

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GHS Pictogram :
GHS No : GHS02,GHS07
Signal Word : Danger
UN#: 1993
Class : 3
Packing Group : Ⅲ
Hazard Statements : H225-H302-H315-H319
Precautionary Statements : P210-P233-P240-P241-P242-P243-P264-P270-P280-P302+P352-P330-P362+P364-P370+P378-P501

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   2.70062
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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