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tert-Btuyl 3-(hydroxymethyl)piperidine-1-carboxylate

  • CAS No. 116574-71-1

  • Cat. No. CS-W019824
  • Purity≥95%
  • MDL No.MFCD03094733

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

tert-Btuyl 3-(hydroxymethyl)piperidine-1-carboxylate|CS-W019824

Structure of 116574-71-1

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General Information

  • CAS No. 116574-71-1
  • Cat. No. CS-W019824
  • Purity ≥95%
  • MDL No. MFCD03094733
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₂₁NO₃
  • Molecular Weight 215.29
  • Synonym(s) Tert-butyl 3-(hydroxymethyl)piperidine-1-carboxylate
  • SMILES O=C(N1CC(CO)CCC1)OC(C)(C)C

Description

Di-tert-butyl malonate is an organic compound that is widely used in organic synthesis for the preparation of various compounds. It is an important intermediate in the synthesis of various compounds, such as pharmaceuticals, agrochemicals, and fine chemicals. It is also used as a catalyst in the synthesis of organic compounds. DTBM is a colorless liquid with a sweet, fruity odor.

Synthesis

  • Route1

    References

    • Batt, Douglas G. Patent: US2004/67935 A1, 2004 ; Location in patent: Page/Page column 28 ; US 20040067935 A1
  • Route2

    References

    • H. LUNDBECK A/S Patent: US2011/92475 A1, 2011 ; Location in patent: Page/Page column 18 ;
  • Route3

    References

    • Bristol-Myers Squibb Company Patent: US5583146 A1, 1996 ; US 5583146 A

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   49.77
  • LogP   1.6258
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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