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Ethyl butyrylacetate  Structure

Ethyl butyrylacetate

Chemical Properties

Melting point -44°C
Boiling point 104 °C22 mm Hg(lit.)
Density  0.989 g/mL at 25 °C(lit.)
FEMA  3683 | ETHYL 3-OXOHEXANOATE
refractive index  n20/D 1.427(lit.)
Flash point 173 °F
storage temp.  Sealed in dry,Room Temperature
solubility  soluble in Chloroform, Dichloromethane, Ethyl Acetate, Methanol
form  Liquid
pka 10.69±0.46(Predicted)
color  Clear colorless
Odor at 100.00 %. sweet green sweaty fruity berry
Odor Type green
biological source synthetic
Water Solubility  IMMISCIBLE
JECFA Number 602
BRN  507689
Stability Stable. Incompatible with strong oxidizing agents.
InChI 1S/C8H14O3/c1-3-5-7(9)6-8(10)11-4-2/h3-6H2,1-2H3
InChIKey KQWWVLVLVYYYDT-UHFFFAOYSA-N
SMILES CCCC(=O)CC(=O)OCC
LogP 1.78
CAS DataBase Reference 3249-68-1(CAS DataBase Reference)
NIST Chemistry Reference Hexanoic acid, 3-oxo-, ethyl ester(3249-68-1)

Safety Information

Safety Statements  24/25
RIDADR  NA 1993 / PGIII
WGK Germany  3
RTECS  MO8420500
HS Code  29183000
Storage Class 10 - Combustible liquids

MSDS

Usage And Synthesis

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