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CS-W001157 4
Total: USD 88.00

6-Chloro-8-iodo-9H-purine

  • CAS No. 1801425-40-0

  • Cat. No. CS-0254899
  • Purity≥98%
  • MDL No.None

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

6-Chloro-8-iodo-9H-purine|CS-0254899

Structure of 1801425-40-0

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General Information

  • CAS No. 1801425-40-0
  • Cat. No. CS-0254899
  • Purity ≥98%
  • MDL No. None
  • Storage -20°C, sealed storage, away from moisture and light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₂ClIN₄
  • Molecular Weight 280.45
  • Synonym(s) None
  • SMILES IC1=NC2=C(Cl)N=CN=C2N1

Description

6-Chloro-8-iodo-9H-purine is a halogenated purine scaffold featuring strategically positioned chlorine and iodine substituents at the 6- and 8-positions, respectively. This electronic and steric profile enables direct incorporation into transition-metal-catalyzed coupling reactions, facilitating rapid access to complex nucleoside analogs and functionalized purine architectures under standard conditions.

Application

6-Chloro-8-iodo-9H-purine serves as a versatile building block for the synthesis of purine-based scaffolds in medicinal chemistry and catalytic cross-coupling applications. The strategically positioned chloro and iodo groups enable sequential functionalization via palladium-catalyzed coupling reactions, offering orthogonal reactivity for diversification. Bench-stable and readily purified by crystallization, it facilitates efficient access to complex heterocyclic architectures with high regiocontrol.

Safety Information

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GHS Pictogram : N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   54.46
  • LogP   1.6109
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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