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CS-W001157 4
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1-((7H-purin-6-yl)thio)propan-2-one

  • CAS No. 5441-78-1

  • Cat. No. CS-0547873
  • Purity≥98%
  • MDL No.None

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

1-((7H-purin-6-yl)thio)propan-2-one|CS-0547873

Structure of 5441-78-1

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General Information

  • CAS No. 5441-78-1
  • Cat. No. CS-0547873
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈N₄OS
  • Molecular Weight 208.24
  • Synonym(s) 2-Propanone, (purin-6-ylthio)-
  • SMILES CC(=O)CSC1=NC=NC2=C1NC=N2

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   71.53
  • LogP   1.034
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   3

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