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CS-W001157 4
Total: USD 88.00

3-Phenoxypropionitrile

  • CAS No. 3055-86-5

  • Cat. No. CS-0204565
  • Purity≥98%
  • MDL No.MFCD00013822

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

3-Phenoxypropionitrile|CS-0204565

Structure of 3055-86-5

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General Information

  • CAS No. 3055-86-5
  • Cat. No. CS-0204565
  • Purity ≥98%
  • MDL No. MFCD00013822
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO
  • Molecular Weight 147.17
  • Synonym(s) 3-Phenoxypropanenitrile
  • SMILES N#CCCOC=1C=CC=CC1

Synthesis

  • Route1
    • null|null
      107-13-1
    • null|null
      108-95-2
    • ~87%
    • 3-Phenoxypropionitrile|CS-0204565
      3055-86-5

    References

    • Zhong, Yong-Li; Boruta, David T.; Gauthier Jr., Donald R.; Askin, David Tetrahedron Letters, 2011 , vol. 52, # 38 p. 4824 - 4826
  • Route2
    • 4-Phenoxybutanamide|CS-0771137
      51992-34-8
    • ~60%
    • 3-Phenoxypropionitrile|CS-0204565
      3055-86-5

    References

    • Correia Synthesis, 1994 , # 11 p. 1127 - 1128
  • Route3
    • null|null
      120828-89-9
    • null|null
      107-13-1
    • ~%
    • null|null
      110827-54-8
    • 3-Phenoxypropionitrile|CS-0204565
      3055-86-5

    References

    • Journal of the American Chemical Society, , vol. 111, # 13 p. 4750 - 4761

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302+H312+H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   33.02
  • LogP   1.97908
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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