Magnesium bis{3-[(4-nitrobenzyl)oxy]-3-oxopropanoate}

Basic Information

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CAS Number

83972-01-4

Molecular Formula

C20H16MgN2O12

Molecular Weight

500.7 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

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

No data available

Melting Point

>300°C

Boiling Point

455.8°C at 760 mmHg

Flash Point

No data available

Vapor Pressure

No data available

SMILES

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C1=CC(=CC=C1COC(=O)CC(=O)[O-])[N+](=O)[O-].C1=CC(=CC=C1COC(=O)CC(=O)[O-])[N+](=O)[O-].[Mg+2]

InChI

InChI=1S/2C10H9NO6.Mg/c2*12-9(13)5-10(14)17-6-7-1-3-8(4-2-7)11(15)16;/h2*1-4H,5-6H2,(H,12,13);/q;;+2/p-2

InChIKey

WAFDWKYNSTVECG-UHFFFAOYSA-L

LogP

0.60240

Complexity

297

Safety Information

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Hazard Statement

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

FT-0659825
magnesium 3-[(4-nitrophenyl)methoxy]-3-oxopropanoate
malonic acid p-nitrobenzyl ester magnesium salt
M0938
A840695
DTXSID601004245
83972-01-4
Malonic acid 4-nitrobenzyl ester magnesium salt
AS-14796
magnesium 3-(4-nitrobenzyloxy)-3-oxopropanoate
W-104127
WAFDWKYNSTVECG-UHFFFAOYSA-L
Magnesium 4-Nitrobenzyl Malonate
Magnesium mono-p-nitrobenzyl malonate
AKOS015964396
MFCD00060141
magnesium 3-[(4-nitrophenyl)methoxy]-3-oxidanylidene-propanoate
magnesium;3-[(4-nitrophenyl)methoxy]-3-oxopropanoate
D91407
75321-09-4
AC-1654
FT-0641560
Magnesium 3-((4-nitrobenzyl)oxy)-3-oxopropanoate
SCHEMBL1919596
magnesium p-nitrobenzyl malonate
ALPHA-BOSWELLICACID
CS-0456113
A848072
Magnesium bis{3-[(4-nitrophenyl)methoxy]-3-oxopropanoate}
105995-50-4
Malonic Acid Mono-4-nitrobenzyl Ester Magnesium Salt

MDL Number

MFCD00060141

Customs Code

2918990090

FAQ

What are the physical and chemical properties of Magnesium bis{3-[(4-nitrobenzyl)oxy]-3-oxopropanoate} (CAS: 83972-01-4)?

Magnesium bis{3-[(4-nitrobenzyl)oxy]-3-oxopropanoate} (CAS: 83972-01-4) is a white crystalline solid with a molecular weight of approximately 422.2 g/mol. It has limited solubility in water but is soluble in organic solvents like methanol and ethanol. This compound is known for its reactivity, particularly in ester formation and nitro group reactivity.

How is Magnesium bis{3-[(4-nitrobenzyl)oxy]-3-oxopropanoate} (CAS: 83972-01-4) typically synthesized?

Magnesium bis{3-[(4-nitrobenzyl)oxy]-3-oxopropanoate} (CAS: 83972-01-4) is synthesized through a multi-step process involving the reaction of 4-nitrobenzyl chloride with 3-hydroxy-2-oxopropionic acid. The synthesis typically requires the use of magnesium metal as a reducing agent and is carried out under anhydrous conditions to ensure high purity and yield.

What industries use Magnesium bis{3-[(4-nitrobenzyl)oxy]-3-oxopropanoate} (CAS: 83972-01-4)?

Magnesium bis{3-[(4-nitrobenzyl)oxy]-3-oxopropanoate} (CAS: 83972-01-4) finds applications in pharmaceuticals for its use as a nitro group protecting reagent, in polymers for controlled release applications, and in sensors and semiconductors for its optical and electronic properties.

What precautions should be taken when handling Magnesium bis{3-[(4-nitrobenzyl)oxy]-3-oxopropanoate} (CAS: 83972-01-4)?

When handling Magnesium bis{3-[(4-nitrobenzyl)oxy]-3-oxopropanoate} (CAS: 83972-01-4), it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be carried out in a well-ventilated area or a fume hood to prevent inhalation of dust. Spills should be cleaned up using appropriate absorbent materials, and the area should be thoroughly washed down with water. Always consult the Safety Data Sheet (SDS) for detailed handling and disposal instructions.