tert-Butyl acetoacetate, 97%, 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: 1694-31-1
• Molecular Formula: C₈H₁₄O₃
• Molecular Weight (g/mol): 158.2
• MDL Number: MFCD00008811
• InChI Key: JKUYRAMKJLMYLO-UHFFFAOYSA-N
• Synonym: tert-butyl acetoacetate, t-butyl acetoacetate, butanoic acid, 3-oxo-, 1,1-dimethylethyl ester, acetoacetic acid, tert-butyl ester, tert-butyl 3-oxobutyrate, acetoacetic acid tert-butyl ester, unii-1d3dos61gx, tbaa, 1d3dos61gx, t-butylacetoacetate
• PubChem CID: 15538
• IUPAC Name: tert-butyl 3-oxobutanoate
• SMILES: CC(=O)CC(=O)OC(C)(C)C

• Melting Point: -38°C
• Color: Colorless to Yellow
• Density: 0.9700g/mL
• Boiling Point: 190°C
• Flash Point: 76°C
• Infrared Spectrum: Authentic
• Assay Percent Range: 96% min. (GC)
• Packaging: Glass bottle
• Refractive Index: 1.4190 to 1.421
• Linear Formula: CH₃COCH₂CO₂C(CH₃)₃
• Quantity: 500 mL
• Fieser: 01,83
• Specific Gravity: 0.97
• Solubility Information: Solubility in water: 9g/L water (20°C). Other solubilities: soluble in xylene,miscible with most organic solvents
• Formula Weight: 158.2
• Percent Purity: 97%
• Physical Form: Liquid
• Chemical Name or Material: tert-Butyl acetoacetate, 99%

Safety and Handling

EINECSNumber	216-904-5
TSCA	TSCA

SDS

RUO – Research Use Only