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CS-W001157 4
Total: USD 88.00

2-Cyanobutanoic acid

  • CAS No. 51789-75-4

  • Cat. No. CS-0453198
  • Purity≥98%
  • MDL No.None

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

2-Cyanobutanoic acid|CS-0453198

Structure of 51789-75-4

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General Information

  • CAS No. 51789-75-4
  • Cat. No. CS-0453198
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₇NO₂
  • Molecular Weight 113.11
  • Synonym(s) α-Ethylcyanoacetic acid
  • SMILES CCC(C#N)C(=O)O

Synthesis

  • Route1
    • null|null
      109-74-0
    • null|null
      124-38-9
    • ~%
    • 2-Cyanobutanoic acid|CS-0453198
      51789-75-4

    References

    • Otero, M. Dolores; Batanero, Belen; Barba, Fructuoso Tetrahedron Letters, 2006 , vol. 47, # 13 p. 2171 - 2173
  • Route2

    References

    • Nishikawa Mem. Ryojun Coll. Eng. Inouye-Festschr. <1934> 390

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   61.09
  • LogP   0.62078
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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