ChemicalBook--->CAS DataBase List--->29214-60-6

29214-60-6

29214-60-6 Structure

29214-60-6 Structure
IdentificationMore
[Name]

Ethyl 2-acetylcaprylate
[CAS]

29214-60-6
[Synonyms]

2-ACETYL-N-OCTANOIC ACID ETHYL ESTER
ETHYL 2-ACETYL-N-OCTANOATE
ETHYL-2-HEXYL ACETOACETATE
ETHYL 2-N-HEXYLACETOACETATE
ETHYL-3-HEXYLACETOACETATE
GELSONE
JESSATE
N-HEXYLACETOACETIC ACID ETHYL ESTER
2-Acetyloctanoicacidethylester
2-acetyl-octanoicaciethylester
ethyl2-acetylcaprylate
ethyl2-acetyloctanoate
ethylalpha-hexylacetoacetate
hexylacetoaceticacidethylester
Octanoicacid,2-acetyl-,ethylester
n-hexylacetoaceticacidethylester95+%
N-HEXYLETHYLACETOACETATE
Ethyl-2-acetyloctanoat
JESSATE 05366, QUEST
2-Hexylacetoacetic acid ethyl ester
[EINECS(EC#)]

249-518-0
[Molecular Formula]

C12H22O3
[MDL Number]

MFCD00026889
[Molecular Weight]

214.3
[MOL File]

29214-60-6.mol
Chemical PropertiesBack Directory
[Boiling point ]

149 °C / 25mmHg
[density ]

0.94
[FEMA ]

4459 | ETHYL 2-ACETYLOCTANOATE
[refractive index ]

1.4320 to 1.4360
[form ]

clear liquid
[pka]

11.89±0.59(Predicted)
[color ]

A colourless slightly oily liquid.
[Odor]

at 100.00 %. methyl dihydrojasmonate fruity jasmin waxy herbal
[Odor Type]

floral
[JECFA Number]

1958
[LogP]

3.72
[CAS DataBase Reference]

29214-60-6(CAS DataBase Reference)
[EPA Substance Registry System]

29214-60-6(EPA Substance)
Safety DataBack Directory
[RTECS ]

RH0352500
[HS Code ]

2918.30.9000
[Toxicity]

Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg (Shelanski, 1973).
Hazard InformationBack Directory
[Occurrence]

Has apparently not been reported to occur in nature.
[Preparation]

By the alkylation of ethyl acetoacetate with hexyl bromide or by any other suitable method. Uses: In public use since the 1950s. Use in fragrances in the USA amounts to approximately 10001b/yr.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 64, p. 580, 1942 DOI: 10.1021/ja01255a035
Spectrum DetailBack Directory
[Spectrum Detail]

Ethyl 2-acetylcaprylate(29214-60-6)MS
Ethyl 2-acetylcaprylate(29214-60-6)1HNMR
Ethyl 2-acetylcaprylate(29214-60-6)13CNMR
Ethyl 2-acetylcaprylate(29214-60-6)IR1
Ethyl 2-acetylcaprylate(29214-60-6)Raman
Well-known Reagent Company Product InformationBack Directory
[TCI AMERICA]

Ethyl 2-Hexylacetoacetate,>95.0%(GC)(29214-60-6)
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