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CS-W001157 4
Total: USD 88.00

2-Cyanopropan-2-yl benzoate

  • CAS No. 32379-42-3

  • Cat. No. CS-0451008
  • Molecule weight189.21
  • Purity≥98%
  • MDL No.None

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

2-Cyanopropan-2-yl benzoate|CS-0451008

Structure of 32379-42-3

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General Information

  • CAS No. 32379-42-3
  • Cat. No. CS-0451008
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁NO₂
  • Molecular Weight 189.21
  • Synonym(s) None
  • SMILES CC(C)(C#N)OC(=O)C1=CC=CC=C1

Synthesis

  • Route1
    • Phenylglyoxylonitrile|CS-0019444
      613-90-1
    • null|null
      67-64-1
    • ~65%
    • 2-Cyanopropan-2-yl benzoate|CS-0451008
      32379-42-3

    References

    • Zhang, Wen; Shi, Min Organic and Biomolecular Chemistry, 2006 , vol. 4, # 9 p. 1671 - 1674
  • Route2
    • null|null
      151-50-8
    • null|null
      98-88-4
    • null|null
      67-64-1
    • ~52%
    • 2-Cyanopropan-2-yl benzoate|CS-0451008
      32379-42-3

    References

    • Chenevert, Robert; Plante, Raymond; Voyer, Normand Synthetic Communications, 1983 , vol. 13, # 5 p. 403 - 410
  • Route3
    • null|null
      347-89-7
    • null|null
      75-86-5
    • ~%
    • 2-Cyanopropan-2-yl benzoate|CS-0451008
      32379-42-3

    References

    • Freeman; Lucas Journal of the American Chemical Society, 1955 , vol. 77, p. 2334

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   50.09
  • LogP   2.14558
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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