Allyl cyclohexanebutyrate
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Allyl cyclohexanebutyrate
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CAS No:
7493-65-4
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Formula:
C13H22O2
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Chemical Name:
Allyl cyclohexanebutyrate
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Synonyms:
Cyclohexanebutanoic acid,2-propen-1-yl ester;Cyclohexanebutyric acid,allyl ester;Cyclohexanebutanoic acid,2-propenyl ester;Allyl cyclohexanebutyrate
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CAS No:
Description
A liquid with pineapple-like aroma. It is used as a flavoring agent or adjuvant
Colourless liquid with a fatty pineapple odour
2-Propenyl cyclohexanebutanoate is a fatty acid ester.
Characteristics
26.30000
3.46620
Colourless liquid with a fatty pineapple odour
0.934g/cm3
283.2ºC at 760 mmHg
118.2ºC
1.459
Insoluble in water, soluble in ethanol, essential oils and flavour chemicals
Allyl cyclohexanebutyrate Use and Manufacturing
In the presence of benzene, it is obtained by direct esterification of cyclohexyl butyric acid and allyl alcohol.
GB 2760-1996 stipulates temporarily allowed use of food spices.
Cyclohexanebutanoic acid, 2-propen-1-yl ester: ACTIVE
Food additives -> Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT; -> JECFA Functional Classes|Flavoring Agents -> JECFA Flavorings Index|Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]
Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT;
Computed Properties
Molecular Weight:210.31
XLogP3:4.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:210.161979940
Monoisotopic Mass:210.161979940
Topological Polar Surface Area:26.3
Heavy Atom Count:15
Complexity:193
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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