Basic information Identification Description Regulatory Status Usage Natural occurrence Safety Related Supplier
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Allyl cyclohexylpropionate

Basic information Identification Description Regulatory Status Usage Natural occurrence Safety Related Supplier
Allyl cyclohexylpropionate Basic information
Allyl cyclohexylpropionate Chemical Properties
Safety Information
  • Hazard Codes Xn
  • Risk Statements 20/21/22
  • Safety Statements 36/37/39-45
  • RIDADR 2810
  • WGK Germany 2
  • RTECS GV6735000
  • HazardClass 6.1(b)
  • PackingGroup III
  • HS Code 29162090
  • ToxicityThe acute oral LD50 has been reported as 585 mg/kg in the rat (B?r & Griepentrog, 1967).
MSDS
Allyl cyclohexylpropionate Usage And Synthesis
  • Identification
    ▼
    ▲
    CAS.No.: 
    2705-87-5 
    FL.No.: 
    9.498
    FEMA.No.: 
    2026
    NAS.No.: 
    2026
    CoE.No.: 
    2223
    EINECS.No.: 
    220-292-5 
    JECFA.No.: 
    13
    　
    　
  • DescriptionA colorless liquid with pineapple aroma. Used as a flavoring agent or adjuvant.
  • Regulatory StatusCoE: Used provisionally. Bev.: 10 ppm; Food: 10 ppm
    FDA: 21 CFR 172.515
    FDA (other): n/a
    JECFA: ADI: Acceptable. No safety concern at current levels of intake when used as a flavoring agent (1996).
  • UsageReported uses (ppm): (FEMA, 1994)
    ▼
    ▲
    Food Category 
    Usual 
    Max. 
    Alcoholic beverages 
    2.33
    5.33
    Baked goods 
    52.27
    71.15
    Chewing gum 
    9.56
    17.21
    Frozen dairy 
    20.11
    28.75
    Gelatins, puddings 
    21.36
    29.81
    Gravies 
    1
    2
    Hard candy 
    7.41
    10
    Nonalcoholic beverages 
    7.2
    13.8
    Soft candy 
    44.97
    57.8
  • Natural occurrenceNot reported found in nature.
  • Chemical PropertiesAllyl cyclohexylpropionate has not been found in nature. It is a colorless liquid with a sweet, fruity odor, reminiscent of pineapples.The ester is prepared by esterification of 3-cyclohexylpropionic acid (obtained by hydrogenation of cinnamic acid) with allyl alcohol. It is used in perfumery to obtain fruity top notes as well as pineapple and chamomile nuances.
  • Chemical PropertiesA colorless liquid with pineapple aroma. Used as a flavoring agent or adjuvant
  • OccurrenceApparently has not been reported to occur in nature.
  • PreparationBy direct esterification of cyclohexylpropionic acid with allyl alcohol in the presence of benzene.
  • Taste threshold valuesTaste characteristics at 30 ppm: fruity, pineapple, waxy, with green sweet apple nuances.
  • Safety ProfilePoison by ingestion. When heated to decomposition it emits acrid smoke and irritating fumes. Combustible liquid. See ALLYL COMPOUNDS and ESTERS
  • MetabolismAllyl compounds are metabolized to mercapturic acid which is excreted in the urine (Clapp, Kaye & Young, 1969). Cyclohexylpropionic acid is aromatized to benzoic acid and excreted as hippuric acid in the urine. Substituted cyclohexylcarboxylic acids are either excreted unchanged or completely oxidized (Williams, 1959).
Allyl cyclohexylpropionate Preparation Products And Raw materials
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