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Ethyl 3-amino-3-methylbutanoate hydrochloride

  • CAS No. 85532-40-7

  • Cat. No. CS-W003795
  • Purity≥97%
  • MDL No.MFCD11844787

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

Ethyl 3-amino-3-methylbutanoate hydrochloride|CS-W003795

Structure of 85532-40-7

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General Information

  • CAS No. 85532-40-7
  • Cat. No. CS-W003795
  • Purity ≥97%
  • MDL No. MFCD11844787
  • Storage Store at room temperature, keep dry and cool
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₆ClNO₂
  • Molecular Weight 181.66
  • Synonym(s) Ethyl 3-Amino-3-methylbutyrate Hydrochloride
  • SMILES CCOC(=O)CC(N)(C)C.Cl

Description

Ethyl 3-amino-3-methylbutanoate hydrochloride is a bench-stable, moisture-tolerant amino ester featuring a tertiary amine center that enables efficient derivatization. This zwitterionic form enhances solubility in polar solvents while maintaining compatibility with standard peptide coupling protocols. The protected amine facilitates incorporation into complex molecular architectures under mild conditions.

Application

Ethyl 3-amino-3-methylbutanoate hydrochloride serves as a versatile building block in medicinal chemistry, enabling efficient access to chiral aliphatic amine scaffolds. The protected primary amine facilitates subsequent functionalization via amidation, reductive amination, or coupling reactions. Its stability under standard synthetic conditions and ease of purification support reliable use in multi-step synthesis of bioactive molecules and heterocyclic intermediates.

Synthesis

  • Route1

    References

    • Journal of Medicinal Chemistry, , vol. 52, # 2 p. 293 - 307

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   52.32
  • LogP   1.0987
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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