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CS-W001157 4
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2-[2-(1h-imidazol-1-yl)ethyl]-2,3-dihydro-1h-isoindole-1,3-dione

  • CAS No. 72459-53-1

  • Cat. No. CS-0258504
  • Purity≥98%
  • MDL No.None

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

2-[2-(1h-imidazol-1-yl)ethyl]-2,3-dihydro-1h-isoindole-1,3-dione|CS-0258504

Structure of 72459-53-1

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General Information

  • CAS No. 72459-53-1
  • Cat. No. CS-0258504
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₁N₃O₂
  • Molecular Weight 241.25
  • Synonym(s) 2-[2-(1H-imidazol-1-yl)ethyl]-1H-isoindole-1,3(2H)-dione
  • SMILES O=C1N(CCN2C=CN=C2)C(C3=C1C=CC=C3)=O

Synthesis

  • Route1

    References

    • Popkov; Skvortsova Russian Chemical Bulletin, 2006 , vol. 55, # 10 p. 1848 - 1851
  • Route2

    References

    • American Cyanamid Company Patent: US4489089 A1, 1984 ;
  • Route3

    References

    • Lur'e et al. Zhurnal Obshchei Khimii, 1939 , vol. 9, p. 1933,1936 Chem. Zentralbl., 1940 , vol. 111, # I p. 2466

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   55.2
  • LogP   1.1793
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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