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Methyl 3-((1H-1,2,4-triazol-1-yl)methyl)benzoate

  • CAS No. 857284-24-3

  • Cat. No. CS-0558382
  • Molecule weight217.22
  • Purity≥98%
  • MDL No.None

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

Methyl 3-((1H-1,2,4-triazol-1-yl)methyl)benzoate|CS-0558382

Structure of 857284-24-3

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General Information

  • CAS No. 857284-24-3
  • Cat. No. CS-0558382
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁N₃O₂
  • Molecular Weight 217.22
  • Synonym(s) Methyl 3-(1H-1,2,4-triazol-1-ylmethyl)benzoate
  • SMILES COC(=O)C1=CC=CC(=C1)CN2C=NC=N2

Synthesis

  • Route1

    References

    • STERIX LIMITED Patent: WO2007/68905 A1, 2007 ; Location in patent: Page/Page column 133-134 ;

Safety Information

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

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Computational Chemistry Data

  • TPSA   57.01
  • LogP   1.113
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   3

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