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CS-W001157 4
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3-(Prop-2-yn-1-yloxy)benzonitrile

  • CAS No. 237748-26-4

  • Cat. No. CS-0250171
  • Molecule weight157.17
  • Purity≥95%
  • MDL No.None

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

3-(Prop-2-yn-1-yloxy)benzonitrile|CS-0250171

Structure of 237748-26-4

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General Information

  • CAS No. 237748-26-4
  • Cat. No. CS-0250171
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₇NO
  • Molecular Weight 157.17
  • Synonym(s) Benzonitrile, 3-(2-propynyloxy)- (9CI)
  • SMILES N#CC1=CC=CC(OCC#C)=C1

Synthesis

  • Route1

    References

    • Nguyen, Son T.; Williams, John D.; Majgier-Baranowska, Helena; Li, Bing; Neelagiri, Venugopal R.; Kim, Hwa-Ok; Peet, Norton P. Synthetic Communications, 2014 , vol. 44, # 9 p. 1307 - 1313
  • Route2

    References

    • Bateman, Stuart A.; Kelly, David P.; Martin, Roger F.; White, Jonathan M. Australian Journal of Chemistry, 1999 , vol. 52, # 4 p. 291 - 301

Safety Information

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GHS Pictogram : N/A
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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   33.02
  • LogP   1.57028
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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