structure of (R)-Diethyl 2-aminopentanedioate hydrochloride

(R)-Diethyl 2-aminopentanedioate hydrochloride

CAS No.: 1001-19-0
M. Wt: 239.69700
M. Fa: C9H18ClNO4
InChI Key: WSEQLMQNPBNMSL-OGFXRTJISA-N
Appearance: Off White Solid

Names and Identifiers of 1001-19-0

CAS Number

1001-19-0

MDL Number

MFCD11111544

IUPAC Name

diethyl (2R)-2-aminopentanedioate;hydrochloride

InChI

InChI=1S/C9H17NO4.ClH/c1-3-13-8(11)6-5-7(10)9(12)14-4-2;/h7H,3-6,10H2,1-2H3;1H/t7-;/m1./s1

InChIKey

WSEQLMQNPBNMSL-OGFXRTJISA-N

Canonical SMILES

CCOC(=O)CCC(C(=O)OCC)N.Cl

Isomeric SMILES

CCOC(=O)CC[C@H](C(=O)OCC)N.Cl

UNSPSC Code

12352100

Physical and chemical properties of 1001-19-0

Exact Mass

239.09200

LogP

1.72240

Melting Point

113-115 ºC

Molecular Formula

C9H18ClNO4

Molecular Weight

239.69700

PSA

78.62000

Storage condition

under inert gas (nitrogen or Argon) at 2-8°C

Safety Information of 1001-19-0

Pictograms

Signal Word

Warning

Safety Data Sheet

Supports customized editing of SDS information and downloading in PDF documents.

Applications of 1001-19-0

(R)-Diethyl 2-aminopentanedioate hydrochloride has several applications across various fields:

  • Pharmaceutical Research: It serves as a precursor for synthesizing drugs and biologically active compounds.
  • Biochemical Studies: Used in studies exploring metabolic pathways and enzyme activities.
  • Agricultural Chemistry: Potential applications in developing agrochemicals or plant growth regulators.

Interaction Studies of 1001-19-0

Research into the interaction of (R)-Diethyl 2-aminopentanedioate hydrochloride with biological systems has shown promising results. Key areas of study include:

  • Protein Binding Studies: Understanding how this compound interacts with proteins can provide insights into its mechanism of action.
  • Receptor Binding Affinity: Investigating its affinity for neurotransmitter receptors may elucidate its neuroprotective potential.
  • Metabolic Pathway Analysis: Studies on how this compound is metabolized in vivo contribute to understanding its pharmacokinetics and dynamics.

Biological Activity of 1001-19-0

(R)-Diethyl 2-aminopentanedioate hydrochloride exhibits various biological activities, primarily due to its structure as an amino acid derivative. It has been studied for its potential roles in metabolic pathways and as a precursor in the synthesis of bioactive compounds. Some notable activities include:

  • Neuroprotective Effects: It may have implications in neuroprotection due to its structural similarity to neurotransmitters.
  • Antioxidant Properties: Compounds related to this structure often exhibit antioxidant activity, which can be beneficial in reducing oxidative stress.

Physical sample testing spectrum (NMR) of 1001-19-0

Physical sample testing spectrum (NMR) of 1001-19-0

Retrosynthesis analysis of 1001-19-0

  • Route#1

    Cas:56-86-0
    Cas:1001-19-0