CAS 28868-76-0: Propanedioic acid, 2-chloro-, 1,3-dimethyl ester

Description: Propanedioic acid, 2-chloro-, 1,3-dimethyl ester, commonly known as dimethyl 2-chloromalonate, is an organic compound characterized by its ester functional groups and a chlorinated carbon atom. It features a propanedioic acid backbone with two methyl ester groups at the 1 and 3 positions and a chlorine substituent at the 2 position. This compound is typically a colorless to pale yellow liquid or solid, depending on its purity and form. It is soluble in organic solvents such as ethanol and ether but has limited solubility in water due to its hydrophobic methyl groups. The presence of the chlorine atom enhances its reactivity, making it useful in various organic synthesis applications, particularly in the preparation of pharmaceuticals and agrochemicals. Additionally, the compound may exhibit moderate toxicity, necessitating careful handling and appropriate safety measures during use. Its chemical structure allows for participation in nucleophilic substitution reactions, making it a valuable intermediate in synthetic organic chemistry.

Formula: C₅H₇ClO₄

InChI: InChI=1S/C5H7ClO4/c1-9-4(7)3(6)5(8)10-2/h3H,1-2H3

InChI key: InChIKey=LNBQBURECUEBKZ-UHFFFAOYSA-N

SMILES: O=C(OC)C(Cl)C(=O)OC

Synonyms:

• 1,3-Dimethyl 2-chloropropanedioate
• 2-Chloro-malonic acid dimethyl ester
• Chloropropanedioic acid dimethyl ester
• Dimethyl 2-chloromalonate
• Dimethyl 2-chloropropanedioate
• Dimethyl Chloropropanedioate
• Dimethyl α-chloromalonate
• Malonic acid, chloro-, dimethyl ester
• Propanedioic acid, 2-chloro-, 1,3-dimethyl ester
• Propanedioic acid, chloro-, dimethyl ester
• Dimethyl chloromalonate

Dimethyl Chloromalonate

CAS: 28868-76-0

• Formula: C₅H₇ClO₄
• Purity: >98.0%(GC)
• Color and Shape: Colorless to Light yellow clear liquid
• Molecular weight: 166.56

Propanedioic acid, 2-chloro-, 1,3-dimethyl ester

CAS: 28868-76-0

• Formula: C₅H₇ClO₄
• Color and Shape: Liquid
• Molecular weight: 166.5597

Dimethyl 2-chloromalonate

CAS: 28868-76-0

• Formula: C₅H₇ClO₄
• Purity: By gc: 93.7% by area (Typical Value in Batch COA)
• Color and Shape: colorless to light yellow liquid
• Molecular weight: 166.56g/mol

Dimethyl 2-chloromalonate

CAS: 28868-76-0

• Purity: 90.0%
• Color and Shape: Liquid, Clear
• Molecular weight: 166.55999755859375

Dimethyl Chloromalonate

CAS: 28868-76-0

Dimethyl chloromalonate is a nucleophilic reagent that reacts with electrophilic sites in the cell. It …

• Formula: C₅H₇ClO₄
• Purity: Min. 95%
• Color and Shape: Liquid
• Molecular weight: 166.56 g/mol