Octyl 2-furoate
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Octyl 2-furoate
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CAS No:
39251-88-2
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Formula:
C13H20O3
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Chemical Name:
Octyl 2-furoate
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Synonyms:
2-Furancarboxylic acid,octyl ester;Octyl 2-furancarboxylate;2-Furoic acid octyl ester;Octyl 2-furoate;n-Octyl 2-furancarboxylate
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CAS No:
Description
Colourless to pale straw liquid; sweet fruity heavy odour
Octyl 2-furoate is a carboxylic ester. It derives from a 2-furoic acid.
Characteristics
39.4 Ų
4.669 (est)
0.988 g/mL at 25 °C(lit.)
125 °C @ Press: 1 Torr
n20/D 1.472(lit.)
5.843 mg/L @ 25 °C (est)|insoluble in water; miscible in fat|miscible (in ethanol)
Octyl 2-furoate Use and Manufacturing
Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents
Computed Properties
Molecular Weight:224.30
XLogP3:4.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:224.14124450
Monoisotopic Mass:224.14124450
Topological Polar Surface Area:39.4
Heavy Atom Count:16
Complexity:192
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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