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3,3-Dimethylbutan-1-amine hydrochloride

  • CAS No. 30564-98-8

  • Cat. No. CS-0036014
  • Purity≥98%
  • MDL No.MFCD11099509

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

3,3-Dimethylbutan-1-amine hydrochloride|CS-0036014

Structure of 30564-98-8

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General Information

  • CAS No. 30564-98-8
  • Cat. No. CS-0036014
  • Purity ≥98%
  • MDL No. MFCD11099509
  • Storage Store at room temperature, keep dry and cool
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₆ClN
  • Molecular Weight 137.65
  • Synonym(s) 3,3-dimethylbutylamine hydrochloride
  • SMILES CC(C)(CCN)C.Cl

Description

3,3-Dimethylbutan-1-amine hydrochloride offers a sterically hindered primary amine functionality with enhanced stability under standard conditions. This bench-stable salt facilitates efficient nucleophilic reactions in synthetic workflows, particularly in the construction of complex amines and amine-derived catalysts.

Application

3,3-Dimethylbutan-1-amine hydrochloride serves as a robust, bench-stable amine building block for medicinal chemistry and process development. Its tertiary carbon adjacent to the amine center enhances metabolic stability and provides steric shielding, facilitating selective functionalization in coupling reactions. The hydrochloride salt form ensures excellent solubility in polar solvents and simplifies purification, enabling efficient incorporation into diverse heterocyclic scaffolds and API intermediates.

Synthesis

  • Route1
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    • In-stock
      3,3-Dimethylbutan-1-amine hydrochloride|CS-0036014
      30564-98-8

    References

    • ELI LILLY AND COMPANY; DECIPHERA PHARMACEUTICALS, LLC; ALLGEIER, Matthew Carl; FLYNN, Daniel L.; KAUFMAN, Michael D.; PATEL, Phenil J.; WOLFANGEL, Craig D. Patent: WO2013/134243 A1, 2013 ; Location in patent: Page/Page column 13-14 ;
  • Route2
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      3302-16-7
    • ~%
    • In-stock
      3,3-Dimethylbutan-1-amine hydrochloride|CS-0036014
      30564-98-8

    References

    • Zhmurova,I.N.; Drach,B.S. J. Gen. Chem. USSR (Engl. Transl.), 1964 , vol. 34, # 9 p. 3055 - 3060,3091 - 3095

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H314-H318
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   1.8031
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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