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CS-W001157 4
Total: USD 88.00

7-Mercapto-4-methyl-2H-chromen-2-one

  • CAS No. 137215-27-1

  • Cat. No. CS-W007225
  • Purity≥96%
  • MDL No.None

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

7-Mercapto-4-methyl-2H-chromen-2-one|CS-W007225

Structure of 137215-27-1

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General Information

  • CAS No. 137215-27-1
  • Cat. No. CS-W007225
  • Purity ≥96%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈O₂S
  • Molecular Weight 192.23
  • Synonym(s) 7-Mercapto-4-methylcoumarin
  • SMILES O=C1C=C(C)C2=C(O1)C=C(S)C=C2

Description

7-Mercapto-4-methyl-2H-chromen-2-one features a reactive thiol group flanked by a methyl-substituted coumarin core, enabling direct conjugation in bioconjugation and materials chemistry. This bench-stable scaffold integrates readily into functionalized polymers and probes, offering enhanced solubility and site-specific reactivity under standard conditions.

Application

7-Mercapto-4-methyl-2H-chromen-2-one serves as a versatile scaffold for the synthesis of bioactive heterocycles, enabling efficient construction of thiochromone-based pharmacophores. Its thiol and ketone functionalities offer orthogonal reactivity for nucleophilic additions, metal-catalyzed couplings, and cyclization reactions. The compound exhibits bench stability and facilitates straightforward purification, making it well-suited for iterative medicinal chemistry campaigns and scale-up applications in API development.

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   30.21
  • LogP   2.39012
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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