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CS-W001157 4
Total: USD 88.00

4-(Dimethylamino)-4-methyl-2-pentynoic acid hydrochloride

  • CAS No. 2595201-64-0

  • Cat. No. CS-0694334
  • Purity≥98%
  • MDL No.None

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

4-(Dimethylamino)-4-methyl-2-pentynoic acid hydrochloride|CS-0694334

Structure of 2595201-64-0

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General Information

  • CAS No. 2595201-64-0
  • Cat. No. CS-0694334
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature, keep dry and cool
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₄ClNO₂
  • Molecular Weight 191.66
  • Synonym(s) None
  • SMILES CC(C)(N(C)C)C#CC(O)=O.Cl

Description

4-(Dimethylamino)-4-methyl-2-pentynoic acid (hydrochloride) features a conjugated alkyne-carboxylic acid motif paired with a tertiary dimethylamino group, enabling efficient coupling in bioconjugation workflows. The hydrochloride salt enhances solubility and stability under standard conditions, facilitating handling in synthetic and medicinal chemistry applications.

Application

4-(Dimethylamino)-4-methyl-2-pentynoic acid (hydrochloride) serves as a versatile building block for the synthesis of α,β-unsaturated carbonyl systems and heterocyclic scaffolds. The terminal alkyne functionality enables efficient copper-catalyzed azide-alkyne cycloaddition (CuAAC), while the carboxylic acid group facilitates peptide coupling and esterification reactions. The dimethylamino group enhances solubility and provides a handle for further functionalization. This compound exhibits good bench stability and is compatible with standard synthetic workflows in medicinal chemistry and materials science.

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   40.54
  • LogP   0.8364
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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