Butanoic acid, 1-ethylhexyl ester
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Butanoic acid, 1-ethylhexyl ester
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CAS No:
20286-45-7
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Formula:
C12H24O2
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Chemical Name:
Butanoic acid, 1-ethylhexyl ester
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Synonyms:
Butanoic acid,1-ethylhexyl ester;Butyric acid,1-ethylhexyl ester;3-Octanol,butyrate
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CAS No:
Characteristics
26.3
4.2
Colourless liquid; Green herbaceous odourÂ
0.8678 (estimate)
-56°C (estimate)
238.06°C (estimate)
1.420-1.425
Practically insoluble or insoluble in water; soluble in fats and oils
Butanoic acid, 1-ethylhexyl ester Use and Manufacturing
Butanoic acid, 1-ethylhexyl ester: INACTIVE
Flavouring Agent -> FLAVOURING_AGENT; -> JECFA Functional Classes|Flavoring Agents -> JECFA Flavorings Index|Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]
Flavouring Agent -> FLAVOURING_AGENT;|Flavoring Agents
Computed Properties
Molecular Weight:200.32
XLogP3:4.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:9
Exact Mass:200.177630004
Monoisotopic Mass:200.177630004
Topological Polar Surface Area:26.3
Heavy Atom Count:14
Complexity:143
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Butanoic acid, 1-ethylhexyl ester
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