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CS-W001157 4
Total: USD 88.00

(2,2-Dimethyl-5-nitro-1,3-dioxan-5-yl)methanol

  • CAS No. 4728-14-7

  • Cat. No. CS-0217474
  • Molecule weight191.18
  • Purity≥95%
  • MDL No.None

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

(2,2-Dimethyl-5-nitro-1,3-dioxan-5-yl)methanol|CS-0217474

Structure of 4728-14-7

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General Information

  • CAS No. 4728-14-7
  • Cat. No. CS-0217474
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₃NO₅
  • Molecular Weight 191.18
  • Synonym(s) 2,2-Dimethyl-5-hydroxymethyl-5-nitro-1,3-dioxane
  • SMILES CC1(C)OCC(CO)(CO1)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Majewski, Marek; Gleave, D. Mark; Nowak, Pawel Canadian Journal of Chemistry, 1995 , vol. 73, # 10 p. 1616 - 1626
  • Route2

    References

    • W. R. Grace and Co.-Conn. Patent: US4851588 A1, 1989 ;
  • Route3

    References

    • Morin, Jesse B.; Sello, Jason K. Organic Letters, 2010 , vol. 12, # 15 p. 3522 - 3524

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-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   81.83
  • LogP   -0.2229
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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