Basic Information of Tert butyl acetoacetate CAS 1694-31-1
Product name: tert butyl acetoacetate
CAS number: 1694-31-1
Molecular formula: C ₈ H ₁₄ O ∝
Molecular weight: 158.195 g/molEINECS number: 216-904-5
Physical and chemical properties
Appearance: Colorless or transparent yellow liquid (slightly different descriptions from different sources, mostly described as colorless and transparent liquid)
Boiling point: 190 ° C (some data shows 71-72 ° C at 11 mmHg)
Melting point: -38 ° C
Density: Approximately 0.954 g/cm ³ (25 ° C)
Flash point: 150 ° F (approximately 65.6 ° C)
Refractive index: n ² ⁰/D ≈ 1.419-1.421
Solubility: Slightly soluble in water, soluble in organic solvents such as alcohols and ethersVapor pressure: 0.749 mmHg (25 ° C)
Specification
Items Specification Testing Results
Appearance Colorless to light yellow clear liquid Conforms
Tert-Butyl acetoacetate,% ≥ 97. 0 99.8
Tert-butyl alcohol,% ≤ 2.0 0.26
Acidity,% ≤ 0. 20 0.02
Water,% ≤ 0. 10 0.02
Chroma/Hazen ≤ 80 <80
Application and Use
- Organic synthesis intermediates: used for synthesizing β - ketoester compounds and are important raw materials for ester condensation reactions
- Pharmaceutical intermediates: used for the preparation of Bcl-2/Bcl xL inhibitors (anti-tumor drugs), HIV-1 inhibitors, etc
- Industrial application: As an acetylation reagent, used in coatings, paints, adhesives, cleaning agents, etc
- Laboratory use: As a non-aqueous solvent, it participates in esterification, etherification and other reactions.
Packing
200kg/HEDP drum or as per request.




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