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CS-W001157 4
Total: USD 88.00

Phenylsulfonylacetonitrile

  • CAS No. 7605-28-9

  • Cat. No. CS-0156059
  • Purity≥98%
  • MDL No.MFCD00007550

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

Phenylsulfonylacetonitrile|CS-0156059

Structure of 7605-28-9

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General Information

  • CAS No. 7605-28-9
  • Cat. No. CS-0156059
  • Purity ≥98%
  • MDL No. MFCD00007550
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇NO₂S
  • Molecular Weight 181.21
  • Synonym(s) phenylsulphonylacetonitrile
  • SMILES C1=CC=C(C=C1)S(=O)(=O)CC#N

Description

Condensation reaction of (phenylsulfonyl)acetonitrile with benzaldehyde in water in heterogeneous phase in the presence and absence of anionic and cationic surfactants has been studied. Dehydrative alkylation of alcohols with (phenylsulfonyl)acetonitrile under modified Mitsunobu conditions has been investigated.(Phenylsulfonyl)acetonitrile was used in the synthesis of pyridines, chromenes and thiophene derivatives based on sulfones.

Synthesis

  • Route1

    References

    • Rahimizadeh, Mohammad; Rajabzadeh, Ghadir; Khatami, Seyed-Mola; Eshghi, Hossein; Shiri, Ali Journal of Molecular Catalysis A: Chemical, 2010 , vol. 323, # 1-2 p. 59 - 64
  • Route2
    • 1-(Phenylsulfonyl)-1H-benzo[d][1,2,3]triazole|CS-0357959
      4106-18-7
    • null|null
      75-05-8
    • ~51%
    • In-stock
      Phenylsulfonylacetonitrile|CS-0156059
      7605-28-9

    References

    • Katritzky, Alan R.; Abdel-Fattah, Ashraf A. A.; Vakulenko, Anatoliy V.; Tao, Hui Journal of Organic Chemistry, 2005 , vol. 70, # 23 p. 9191 - 9197
  • Route3
    • In-stock
      Sodium benzenesulfinate|CS-W014314
      873-55-2
    • null|null
      590-17-0
    • ~92%
    • In-stock
      Phenylsulfonylacetonitrile|CS-0156059
      7605-28-9

    References

    • Bram, Georges; Loupy, Andre; Roux-Schmitt, Marie Claude; Sansoulet, Jean; Strzalko, Tekla; Seyden-Penne, Jacqueline Synthesis, 1987 , # 1 p. 56 - 59

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301+H311+H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   57.93
  • LogP   0.98388
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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