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Isobutyl acetoacetate

CAS 7779-75-1CH3COCH2COOCH2CH(CH3)3Chemical Synthesis

Isobutyl acetoacetate (CAS: 7779-75-1) is an organic compound with the linear formula CH3COCH2COOCH2CH(CH3)3 and a molecular weight of 158.19 g/mol. This clear liquid, also known as Lonza quality grade, functions as a versatile building block in chemical synthesis. It is particularly valuable in reactions involving carbonyl compounds and esters, contributing to the development of more complex organic molecules. Its properties make it a key intermediate in various chemical manufacturing processes.

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Isobutyl acetoacetate (CH3COCH2COOCH2CH(CH3)3) — chemical structure, CAS 7779-75-1; Chemistry, fine chemical supplied by Tech Serve Solutions
Building BlocksC8 to C9Carbonyl CompoundsChemical SynthesisEsters
01 /Applications

Organic Synthesis Intermediate

Isobutyl acetoacetate serves as a crucial intermediate in the synthesis of diverse organic compounds. Its reactive methylene group and ester functionalities allow for various condensation and alkylation reactions.

Building Block for Heterocycles

The compound is employed in the construction of heterocyclic ring systems, which are prevalent in pharmaceuticals and agrochemicals. It participates in cyclisation reactions to form diverse ring structures.

Precursor for Specialty Chemicals

It acts as a precursor in the manufacture of specialty chemicals, contributing to the development of novel materials and performance chemicals. Its structure allows for tailored modifications.

02 /Properties
Molecular weight158.19
Linear formulaCH3COCH2COOCH2CH(CH3)3
Assay≥96.0% (GC)
GradeLonza quality
Formliquid
Colourclear
Boiling point100 °C/22 mmHg(lit.)
Density0.98 g/mL at 25 °C(lit.)
Refractive indexn20/D 1.424(lit.)
03 /Safety & handling
Protective equipmentEyeshields, Gloves, half-mask respirator (EU), half-mask respirator (US), multi-purpose combination respirator cartridge (US)
Flash point78 °C / 172.4 °F
Water hazard class (WGK, DE)3

Hazard information is provided for guidance. Always consult the product Safety Data Sheet (SDS), available on request, before handling.

04 /Identifiers & registry
CAS number
7779-75-1
Beilstein registry
1761405
05 /Additional specifications
Mfr NoLonza Ltd
06 /Quality & supply

Documentation

Every batch ships with a Certificate of Analysis covering assay, identity and purity; the grade is confirmed against your enquiry. Safety Data Sheets and technical data sheets are available on request.

Supply & logistics

Samples for technical evaluation; bulk MOQ by grade and packaging. In-stock material ships in 7–10 working days, worldwide, with full export documentation.

07 /Frequently asked questions

What is Isobutyl acetoacetate used for?

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Isobutyl acetoacetate is used as a versatile building block and intermediate in organic synthesis, particularly for constructing complex organic molecules and heterocyclic compounds.

What is the CAS number and formula for Isobutyl acetoacetate?

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The CAS number for Isobutyl acetoacetate is 7779-75-1, and its linear formula is CH3COCH2COOCH2CH(CH3)3.

What grade and purity does Tech Serve Solutions supply?

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Tech Serve Solutions supplies Isobutyl acetoacetate in Lonza quality grade, with an assay of ≥96.0% (GC). We do not represent this product as USP, BP, or EP grade.

How should Isobutyl acetoacetate be handled safely?

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Handle Isobutyl acetoacetate with appropriate personal protective equipment, including eyeshields and gloves. Ensure adequate ventilation and use a suitable respirator if needed, as indicated by its GHS hazards.

Is Isobutyl acetoacetate a controlled substance?

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The provided data does not indicate that Isobutyl acetoacetate (CAS: 7779-75-1) is a controlled substance.

How is Isobutyl acetoacetate packed and exported by TSS?

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Tech Serve Solutions, as a global supplier and exporter, ensures appropriate packaging and handling for the international shipment of Isobutyl acetoacetate, adhering to all relevant regulations.

How can I request a quote or sample of Isobutyl acetoacetate?

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To request a quote or sample of Isobutyl acetoacetate, please contact our sales team through the designated channels on the Tech Serve Solutions website.

Need Isobutyl acetoacetate in a specific grade or volume?