D-Alanine isopropyl ester hcl

Basic Information

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CAS Number

39613-92-8

Molecular Formula

C6H14ClNO2

Molecular Weight

167.64 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Physical Properties

SMILES

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CC(C)OC(=O)C(C)N.Cl

InChI

InChI=1S/C6H13NO2.ClH/c1-4(2)9-6(8)5(3)7;/h4-5H,7H2,1-3H3;1H/t5-;/m1./s1

InChIKey

YAQKNCSWDMGPOY-NUBCRITNSA-N

LogP

0.7070000000000002

Topological Polar Surface Area

52.32 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

101

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

D-Alanine 1-methylethyl ester HCl
H-D-Ala-OiPr・HCl
D-Alanine isopropyl ester hydrochloride
H-D-Ala-OiPr.HCl
D-Alanine Isopropyl Ester HCl
H-D-Ala-OiPr•HCl
(S)-isopropyl 2-aminopropanoate hydrochloride
alanine isopropyl ester hydrochloride
Ala-OiPr HCl
D-Alanine isopropyl ester (hydrochloride)
H-D-Ala-OiPr·HCl
isopropyl (2S)-2-aminopropanoate hydrochloride
isopropyl L-alaninate hydrochloride
L-Alanin-1-methylethylester-hydrochlorid
isopropyl D-alaninate
hydrochloride (1:1)
Isopropyl D-alaninate hydrochloride
D-ALANINE ISOPROPYL ESTER HCL
(R)-Isopropyl 2-aminopropanoate hydrochloride
F20403
EN300-109068
DB-264735
A924567
6LC68GE9SC
CS-M2998
AKOS015908252
D-Alanine 1-Methylethyl Ester Hydrochloride
AS-17655
D-Alanine, 1-methylethyl ester, hydrochloride
H-D-Ala-OiPr HCl
Z1431904013

MDL Number

MFCD17976853

FAQ

What regulatory guidelines apply to D-Alanine isopropyl ester HCl (CAS: 39613-92-8)?

D-Alanine isopropyl ester HCl (CAS: 39613-92-8) falls under various regulatory frameworks. Under GHS, it is classified based on its physical and chemical properties. In the European Union, it is subject to REACH regulations which require registration, evaluation, authorization, and restriction of chemical substances. Additionally, the FDA and EPA may have specific requirements for its use in pharmaceuticals and environmental releases, respectively.

Are there alternatives to D-Alanine isopropyl ester HCl (CAS: 39613-92-8) in synthesis?

Alternative reagents for synthesizing similar functionalities include other amino acid esters like L-Alanine isopropyl ester or even other acid derivatives. Isomers or analogs such as D-Alanine methyl ester can also serve as alternatives depending on the specific application. These alternatives can offer similar functionality in different contexts, making them viable substitutes.

What is the market or research trend for D-Alanine isopropyl ester HCl (CAS: 39613-92-8)?

The market for D-Alanine isopropyl ester HCl (CAS: 39613-92-8) has been growing due to its applications in pharmaceuticals and as a food additive. Recent research trends focus on its potential in drug delivery systems and as a flavor enhancer. There is also increasing interest in developing more sustainable synthesis methods and exploring its use in biotechnology and materials science.

How should waste containing D-Alanine isopropyl ester HCl (CAS: 39613-92-8) be handled?

Waste containing D-Alanine isopropyl ester HCl (CAS: 39613-92-8) should be collected in appropriate containers and labeled accordingly. It should be disposed of through professional waste disposal services to ensure compliance with environmental regulations. Proper incineration or landfill disposal methods should be used, and precautions must be taken to prevent environmental contamination. Always consult the most current MSDS and local regulations for specific handling instructions.