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dodecyl acetoacetate
lauryl acetoacetate

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Name:dodecyl 3-oxobutanoate
CAS Number: 52406-22-1Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:257-896-3
Nikkaji Web:J38.354F
XlogP3:5.40 (est)
Molecular Weight:270.41270000
Formula:C16 H30 O3
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:information only not used for fragrances or flavors
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
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Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 308.00 to 310.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.001000 mmHg @ 25.00 °C. (est)
Flash Point: 260.00 °F. TCC ( 126.67 °C. )
logP (o/w): 5.462 (est)
Soluble in:
 water, 1.734 mg/L @ 25 °C (est)
Insoluble in:
Similar Items:note
amyl acetoacetate
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para-anisyl acetoacetate
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bergamot acetoacetate
butyl acetoacetate
isobutyl acetoacetate
cinnamyl acetoacetate
cyclohexyl acetoacetate
ethyl 2-ethyl acetoacetate
ethyl acetoacetate
geranyl acetoacetate
heptyl acetoacetate
(Z)-3-hexen-1-yl acetoacetate
hexyl acetoacetate
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Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
Cosmetic Information:
None found
BOC Sciences
For experimental / research use only.
Acetoacetic acid dodecyl ester
Lonza Group
Dodecyl Acetoacetate
Odor: characteristic
Use: Intermediate for the manufacturing of pharmaceutical products and other various applications.
Safety Information:
Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
Safety in Use Information:
information only not used for fragrances or flavors
Recommendation for dodecyl acetoacetate usage levels up to:
 not for fragrance use.
Recommendation for dodecyl acetoacetate flavor usage levels up to:
 not for flavor use.
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :104190
National Institute of Allergy and Infectious Diseases:Data
dodecyl 3-oxobutanoate
 dodecyl 3-oxobutanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):104190
Pubchem (sid):135061600
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
Potential Blenders and core components note
None Found
Potential Uses:
None Found
Occurrence (nature, food, other):note
 not found in nature
3-oxobutanoic acid dodecyl ester
 butanoic acid, 3-oxo-, dodecyl ester
 dodecyl 3-oxobutanoate
 lauryl acetoacetate
None found
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