Diethyl phenylmalonate, 98%, Thermo Scientific Chemicals

Description

This Thermo Scientific Chemicals brand product was originally part of the Acros Organics product portfolio. Some documentation and label information may refer to the legacy brand. The original Acros Organics product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Specifications

Chemical Identifiers

• CAS: 83-13-6
• MDL Number: MFCD00009144
• InChI Key: FGYDHYCFHBSNPE-UHFFFAOYSA-N
• Synonym: diethyl phenylmalonate, diethyl 2-phenylmalonate, phenylmalonic acid diethyl ester, propanedioic acid, phenyl-, diethyl ester, diethylphenylmalonate, 1,3-diethyl 2-phenylpropanedioate, malonic acid, phenyl-, diethyl ester, propanedioic acid, 2-phenyl-, 1,3-diethyl ester, diethyl 2-phenylpropane-1,3-dioate, diethyl-phenylmalonate
• PubChem CID: 66514
• IUPAC Name: diethyl 2-phenylpropanedioate
• SMILES: CCOC(=O)C(C1=CC=CC=C1)C(=O)OCC

• Melting Point: 16.0°C to 17.0°C
• Color: Colorless to Yellow
• Density: 1.0900g/mL
• Boiling Point: 170.0°C to 172.0°C (14.0 mmHg)
• Flash Point: >112°C
• Infrared Spectrum: Authentic
• Assay Percent Range: 97.5% min. (GC)
• Packaging: Glass bottle
• Molecular Formula: C₁₃H₁₆O₄
• Linear Formula: C₂H₅O₂CCH(C₆H₅)CO₂C₂H₅
• Refractive Index: 1.4903 to 1.4923
• Quantity: 250 mL
• Beilstein: 09, 854
• Specific Gravity: 1.09
• Solubility Information: Solubility in water: immiscible
• Molecular Weight (g/mol): 236.27
• Formula Weight: 236.27
• Percent Purity: 98%
• Physical Form: Liquid After Melting
• Chemical Name or Material: Diethyl phenylmalonate

Safety and Handling

Product Identifier

• Diethyl phenylmalonate

RUO – Research Use Only