ethyl 4,4,4-trimethyl acetoacetate

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ethyl pivaloyl acetate

CAS: 17094-34-7 C9 H16 O3 MW: 172.22412000
All Ingredients Aromatic Ingredients CAS Numbers EINECS Numbers Found in Nature M.W Index

Identification

Nameethyl 4,4,4-trimethyl acetoacetate
IUPACethyl 4,4-dimethyl-3-oxopentanoate
CAS Number17094-34-7
EINECS241-162-4
FDA UNIIRHZ3L061FH
Molecular FormulaC9 H16 O3
Molecular Weight172.22412000
MDL NumberMFCD00042886
Nikkaji NumberJ56.057J
Beilstein1767555
XlogP31.60 (est)

Regulatory

Physical Properties

Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Boiling Point 198.90 °C. @ 760.00 mm Hg (est)
Vapor Pressure 0.400000 mmHg @ 25.00 °C. (est)
Flash Point 165.00 °F. TCC ( 74.10 °C. ) (est)
logP (o/w) 1.940 (est)
Soluble in water, 6146 mg/L @ 25 °C (est)

No sensory data available

Safety Information

Preferred SDSView
Oral/Parenteral ToxicityNot determined
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categorynatural substances and extractives
Recommendation for ethyl 4,4,4-trimethyl acetoacetate usage levels up tonot for fragrance use.
Recommendation for ethyl 4,4,4-trimethyl acetoacetate flavor usage levels up tonot for flavor use.

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17094-34-7 Ethyl pivaloylacetate
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D1891 Ethyl 4,4-Dimethyl-3-oxovalerate >98.0%(GC)
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Potential Uses

None Found

Natural Occurrence

wine

Synonyms

4,4- dimethyl-3-oxopentanoic acid ethyl ester 4,4- dimethyl-3-oxovaleric acid ethyl ester ethyl (2,2-dimethylpropionyl)acetate ethyl 3-oxo-4,4-dimethylpentanoate ethyl 4,4-dimethyl-3-oxo-pentanoate ethyl 4,4-dimethyl-3-oxopentanoate ethyl 4,4-dimethyl-3-oxovalerate ethyl 4,4,4-trimethylacetoacetate ethyl pivaloyl acetate ethyl pivaloylacetate ethyl-3-oxo-4,4-dimethylpentanoate pentanoic acid, 4,4-dimethyl-3-oxo-, ethyl ester valeric acid, 4,4-dimethyl-3-oxo-, ethyl ester Try the PubMed Search.