Diethyl bromo(methyl)malonate

Basic Information

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CAS Number

29263-94-3

Molecular Formula

C8H13BrO4

Molecular Weight

253.09 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 Physical Properties

Boiling Point

59°C/0.2mmHg

Refractive Index

n20/D 1.449(lit.)

SMILES

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CCOC(=O)C(C)(C(=O)OCC)Br

InChI

InChI=1S/C8H13BrO4/c1-4-12-6(10)8(3,9)7(11)13-5-2/h4-5H2,1-3H3

InChIKey

CSLQAXTUGPUBCW-UHFFFAOYSA-N

LogP

1.2662

Topological Polar Surface Area

52.60000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

184

Safety Information

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GHS Hazard Pictograms

H314

Hazard Statement

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Hazard Class

Class 8 Class 8

Synonyms & References

English

Diethyl 2-bromo-2-methylmalonate
Diethyl methylbromomalonate
diethyl 2-bromo-2-methylpropanedioate
1,3-diethyl 2-bromo-2-methylpropanedioate
diethyl-2-bromo-2-methyl-malonate
C8H13BrO4
2-bromo-2-methyl-malonic acid diethyl ester
diethyl-2-bromo-2-methyl malonate
2-Bromo-2-methylpropandioic acid diethyl ester
MFCD00009125
CS-W001079
AKOS015900374
Malonic acid, bromomethyl-, diethyl ester
LS-13461
NS00028660
NSC-10117
diethyl 2-bromo-2-methyl-propanedioate;Diethyl 2-Bromo-2-methylmalonate
InChI=1/C8H13BrO4/c1-4-12-6(10)8(3,9)7(11)13-5-2/h4-5H2,1-3H3
DTXSID90183518
FT-0624770
EN300-243691
FT-0611396
NSC10117
29263-94-3
2-bromo-2-methylmalonic acid diethyl ester
Diethyl2-bromo-2-methylmalonate
Propanedioic acid, bromomethyl-, diethyl ester
SCHEMBL653853
Diethyl 2-bromo-2-methylmalonate, 98%
2-(bromomethyl)-propanedioic acid diethyl ester
D4368

MDL Number

MFCD00009125

Customs Code

2917190090

FAQ

What is Diethyl bromo(methyl)malonate (CAS: 29263-94-3)?

Diethyl bromo(methyl)malonate (CAS: 29263-94-3) is an organic compound with the molecular formula C7H10BrO3. It is a colorless liquid with a distinctive odor. This compound is used in the synthesis of various pharmaceuticals and agrochemicals due to its functional groups.

What are the main uses of Diethyl bromo(methyl)malonate (CAS: 29263-94-3)?

Diethyl bromo(methyl)malonate (CAS: 29263-94-3) is primarily used in the pharmaceutical and agrochemical industries for the synthesis of drugs and pesticides. It is also used as a precursor in the chemical industry for creating other organic compounds.

Is Diethyl bromo(methyl)malonate (CAS: 29263-94-3) safe?

Diethyl bromo(methyl)malonate (CAS: 29263-94-3) is generally considered safe when handled properly. However, it is a flammable liquid and may cause skin and eye irritation. Proper protective measures, such as gloves and goggles, should be used when working with this compound.

How should Diethyl bromo(methyl)malonate (CAS: 29263-94-3) be stored?

Diethyl bromo(methyl)malonate (CAS: 29263-94-3) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly closed container to prevent exposure to moisture and air. Store it at room temperature (15-25°C) and avoid vigorous shaking or agitation.