3249-68-1
Product Name:
Ethyl butyrylacetate
Formula:
C8H14O3
Synonyms:
Ethyl butyrylacetate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | colourless liquid with fruity, slightly fatty odour |
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Boiling Point | 104.00 °C. @ 22.00 mm Hg |
Solubility | slightly |
Density | 0.983-1.000 (20°) |
Refractive Index | 1.424-1.436 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Skull and Crossbones Acute Toxicity GHS06 |
GHS Hazard Statements |
H227:Flammable liquids H301:Acute toxicity,oral |
Precautionary Statement Codes |
P405:Store locked up. P403+P235:Store in a well-ventilated place. Keep cool. |
COMPUTED DESCRIPTORS
Molecular Weight | 158.19 g/mol |
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XLogP3 | 1.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 6 |
Exact Mass | 158.094294304 g/mol |
Monoisotopic Mass | 158.094294304 g/mol |
Topological Polar Surface Area | 43.4 Ų |
Heavy Atom Count | 11 |
Formal Charge | 0 |
Complexity | 140 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Ethyl 3-oxohexanoate is a fatty acid ethyl ester. It is functionally related to a 3-oxohexanoic acid.