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CS-W001157 4
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2-Amino-2-methylpropanenitrile hydrochloride

  • CAS No. 50846-36-1

  • Cat. No. CS-W005215
  • Purity≥95%
  • MDL No.MFCD08456816

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

2-Amino-2-methylpropanenitrile hydrochloride|CS-W005215

Structure of 50846-36-1

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General Information

  • CAS No. 50846-36-1
  • Cat. No. CS-W005215
  • Purity ≥95%
  • MDL No. MFCD08456816
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₉ClN₂
  • Molecular Weight 120.58
  • Synonym(s) alpha-aminoisobutyronitrile hydrochloride
  • SMILES CC(C)(N)C#N.[H]Cl

Description

2-Amino-2-methylpropanenitrile hydrochloride features a sterically hindered tertiary amine and nitrile functionality, enabling robust coupling reactions under mild conditions. This bench-stable salt delivers high reactivity in nucleophilic additions and serves as a key intermediate in the synthesis of bioactive heterocycles and amino acid analogs.

Application

2-Amino-2-methylpropanenitrile hydrochloride serves as a stable, bench-ready building block for the synthesis of nitrile-containing heterocycles and amino acid derivatives. Its functional group tolerance enables straightforward incorporation into diverse synthetic sequences, including cyclization reactions and nucleophilic substitutions. The hydrochloride salt enhances solubility and handling, facilitating purification and scalability in medicinal chemistry and process development workflows.

Synthesis

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      2-Amino-2-methylpropanenitrile hydrochloride|CS-W005215
      50846-36-1

    References

    • MERCK FROSST CANADA and CO. Patent: WO2005/21487 A1, 2005 ; Location in patent: Page/Page column 64-65 ;
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      2-Amino-2-methylpropanenitrile hydrochloride|CS-W005215
      50846-36-1

    References

    • Paventi, Martino; Edward, John T. Canadian Journal of Chemistry, 1987 , vol. 65, p. 282 - 289

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   49.81
  • LogP   0.66908
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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