heptyl acetoacetate

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acetoacetic acid N-heptyl ester

CAS: 42598-96-9 C11 H20 O3 MW: 200.27800000
All Ingredients Aromatic Ingredients CAS Numbers EINECS Numbers M.W Index

Identification

Nameheptyl acetoacetate
IUPACheptyl 3-oxobutanoate
CAS Number42598-96-9
EINECS255-906-0
FDA UNIIHAH2L2R7WR
Molecular FormulaC11 H20 O3
Molecular Weight200.27800000
MDL NumberMFCD00027313
Nikkaji NumberJ207.938K
XlogP32.80 (est)

Regulatory

Physical Properties

Appearance colorless clear liquid (est)
Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Boiling Point 245.00 to 247.00 °C. @ 760.00 mm Hg
Vapor Pressure 0.028000 mmHg @ 25.00 °C. (est)
Flash Point 209.00 °F. TCC ( 98.33 °C. )
logP (o/w) 2.915 (est)
Soluble in alcohol
Insoluble in water
Similar Items note

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

Categoryinformation only not used for fragrances or flavors
Recommendation for heptyl acetoacetate usage levels up tonot for fragrance use.
Recommendation for heptyl acetoacetate flavor usage levels up tonot for flavor use.

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Potential Uses

None Found

Natural Occurrence

not found in nature

Synonyms

acetoacetic acid N-heptyl ester butanoic acid, 3-oxo-, heptyl ester heptyl 3-oxobutanoate Try the PubMed Search.