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CS-W001157 4
Total: USD 88.00

2,2'-[PRopane-2,2-diylbis(thio)]diacetic acid

  • CAS No. 4265-58-1

  • Cat. No. CS-0154349
  • Purity≥97%
  • MDL No.MFCD01830380

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

2,2'-[PRopane-2,2-diylbis(thio)]diacetic acid|CS-0154349

Structure of 4265-58-1

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General Information

  • CAS No. 4265-58-1
  • Cat. No. CS-0154349
  • Purity ≥97%
  • MDL No. MFCD01830380
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₂O₄S₂
  • Molecular Weight 224.30
  • Synonym(s) 2-[2-(carboxymethylsulfanyl)propan-2-ylsulfanyl]acetic acid
  • SMILES CC(C)(SCC(=O)O)SCC(=O)O

Description

This dithioacetic acid derivative features a central propane bridge linking two thioacetic acid groups, enabling robust chelation of metal ions. The structure combines enhanced stability with high affinity for soft metals, making it valuable in coordination chemistry and catalytic systems requiring durable ligand frameworks under ambient conditions.

Application

2,2'-[Propane-2,2-diylbis(thio)]diacetic acid serves as a versatile bifunctional building block for constructing sulfur-containing heterocycles and peptide mimetics. Its two thioacetic acid termini enable efficient conjugation via nucleophilic substitution or metal-mediated coupling, offering high functional group tolerance and stability under standard bench conditions. The molecule facilitates the synthesis of constrained scaffolds relevant to medicinal chemistry and catalytic ligand design.

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   74.6
  • LogP   1.3581
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   6

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