Dimethyl propylmalonate

Basic Information

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CAS Number

14035-96-2

Molecular Formula

C8H14O4

Molecular Weight

174.2 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

SMILES

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CCCC(C(=O)OC)C(=O)OC

InChI

InChI=1S/C8H14O4/c1-4-5-6(7(9)11-2)8(10)12-3/h6H,4-5H2,1-3H3

InChIKey

GQTSAGKZHIWKMR-UHFFFAOYSA-N

LogP

0.7486999999999999

Topological Polar Surface Area

52.60000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

148

Synonyms & References

English

D70239
2-propyl-propanedioic acid dimethyl ester
FT-0659236
DIMETHYL PROPYLMALONATE
1,3-dimethoxy-1,3-dioxo-2-propylpropan-2-yl
AKOS006287329
dimethyl propylpropanedioate
SY113644
DTXSID40930771
Propanedioic acid, propyl-, dimethyl ester
163033-62-3
2-propyl-propanedioicaciddimethylester
AMY36991
MFCD07778475
2-propyl malonic acid dimethyl ester
14035-96-2
Dimethyl 2-propylmalonate #
Malonic acid, propyl-, dimethyl ester
SCHEMBL2946633
Dimethylpropylmalonate
dimethyl 2-propylpropanedioate
Propanedioic acid, 2-propyl-, 1,3-dimethyl ester
CS-0152455
Dimethyl 2-propylmalonate
DS-4948
Dimethyl Propylmalonate
Propyl Methyl Malonate
DIMETHYL PROPYLPROPANEDIOATE
Propylmalonic acid dimethyl ester
2-Propylmalonic acid dimethyl ester
2-Propyl-malonic acid 1,3-dimethyl ester

MDL Number

MFCD07778475

Customs Code

2917190090

FAQ

What are the physical and chemical properties of Dimethyl propylmalonate (CAS: 14035-96-2)?

Dimethyl propylmalonate (CAS: 14035-96-2) is a colorless to slightly yellowish crystalline solid. It has a molecular weight of approximately 204.23 g/mol. The compound is soluble in organic solvents like ethanol and acetone but has low solubility in water. It is reactive towards nucleophiles and can undergo esterification and ester hydrolysis reactions.

How is Dimethyl propylmalonate (CAS: 14035-96-2) typically synthesized?

Dimethyl propylmalonate (CAS: 14035-96-2) is synthesized by the reaction of propylmalonic acid with dimethyl sulfate. This process involves a nucleophilic substitution reaction where the carboxylic acid group of propylmalonic acid is methylated. The reaction is typically carried out in the presence of a strong base such as sodium hydride or potassium hydroxide.

What industries use Dimethyl propylmalonate (CAS: 14035-96-2)?

Dimethyl propylmalonate (CAS: 14035-96-2) is used in the pharmaceutical industry for the synthesis of certain drugs. It is also utilized in the polymer industry as a monomer or additive. Additionally, it finds applications in the production of electronic materials and in the development of chemical sensors due to its reactivity and specific functional groups.

What precautions should be taken when handling Dimethyl propylmalonate (CAS: 14035-96-2)?

When handling Dimethyl propylmalonate (CAS: 14035-96-2), it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood. Spills should be cleaned up immediately using appropriate absorbent materials. Storage should be in a cool, dry place away from heat sources and direct sunlight. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions.