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CS-W001157 4
Total: USD 88.00

Tert-butyl 2-((4S,6S)-6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl)acetate

  • CAS No. 196085-85-5

  • Cat. No. CS-0552392
  • Molecule weight269.34
  • Purity≥98%
  • MDL No.None

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

Tert-butyl 2-((4S,6S)-6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl)acetate|CS-0552392

Structure of 196085-85-5

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General Information

  • CAS No. 196085-85-5
  • Cat. No. CS-0552392
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₂₃NO₄
  • Molecular Weight 269.34
  • Synonym(s) tert-butyl 2-((4S,6S)-6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan- 4-yl)acetate
  • SMILES CC1(O[C@H](C[C@H](O1)CC(=O)OC(C)(C)C)CC#N)C

Synthesis

  • Route1
    • null|null
      1105067-92-2
    • null|null
      77-76-9
    • ~%
    • Tert-butyl 2-((4S,6S)-6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl)acetate|CS-0552392
      196085-85-5

    References

    • Stach, Jan; Havlicek, Jaroslav; Placek, Lukas; Radl, Stanislav Collection of Czechoslovak Chemical Communications, 2008 , vol. 73, # 2 p. 229 - 246

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   68.55
  • LogP   2.54208
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   3

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