structure of Benzyl 3-aminopropanoate hydrochloride

Benzyl 3-aminopropanoate hydrochloride

CAS No.: 99616-43-0
M. Wt: 215.68
M. Fa: C10H14ClNO2
InChI Key: QIBWNGWEFYSLCM-UHFFFAOYSA-N
Appearance: White Solid

Names and Identifiers of Benzyl 3-aminopropanoate hydrochloride

CAS Number

99616-43-0

EC Number

852-473-5

MDL Number

MFCD22378745

IUPAC Name

benzyl 3-aminopropanoate;hydrochloride

InChI

InChI=1S/C10H13NO2.ClH/c11-7-6-10(12)13-8-9-4-2-1-3-5-9;/h1-5H,6-8,11H2;1H

InChIKey

QIBWNGWEFYSLCM-UHFFFAOYSA-N

Canonical SMILES

C1=CC=C(C=C1)COC(=O)CCN.Cl

UNSPSC Code

12352100

Physical and chemical properties of Benzyl 3-aminopropanoate hydrochloride

H Bond Acceptors

2

H Bond Donors

1

LogP

0.959904352666666

Melting Point

100-101 °C

Molecular Formula

C10H14ClNO2

Molecular Weight

215.68

Safety Information of Benzyl 3-aminopropanoate hydrochloride

Pictograms

Signal Word

Warning

Safety Data Sheet

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

Applications of Benzyl 3-aminopropanoate hydrochloride

Benzyl 3-aminopropanoate hydrochloride has various applications, including:

  • Pharmaceutical Development: As a cysteine prodrug, it is being explored for its potential use in treating neurodegenerative diseases and certain cancers due to its anti-apoptotic properties.
  • Research Tool: It serves as a valuable reagent in biochemical research for studying amino acid metabolism and cellular signaling pathways.
  • Chemical Intermediate: The compound can be used as an intermediate in synthesizing other biologically active compounds or pharmaceuticals.

Interaction Studies of Benzyl 3-aminopropanoate hydrochloride

Studies focusing on the interactions of Benzyl 3-aminopropanoate hydrochloride reveal its potential effects on cellular pathways related to apoptosis and cell survival. It has been shown to modulate various signaling pathways that are crucial for maintaining cellular homeostasis under stress conditions. Further research is needed to elucidate its precise mechanisms of action and potential interactions with other biochemical agents.

Biological Activity of Benzyl 3-aminopropanoate hydrochloride

Benzyl 3-aminopropanoate hydrochloride exhibits notable biological activities, primarily linked to its role as a cysteine prodrug. Research indicates that it possesses anti-apoptotic properties, meaning it can inhibit programmed cell death, which is significant in cancer therapy and neuroprotection. Additionally, studies have shown that this compound may enhance cellular survival under stress conditions, making it a candidate for further research in therapeutic applications.

Physical sample testing spectrum (NMR) of Benzyl 3-aminopropanoate hydrochloride

Physical sample testing spectrum (NMR) of Benzyl 3-aminopropanoate hydrochloride

Retrosynthesis analysis of Benzyl 3-aminopropanoate hydrochloride

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