ALLYLCYCLOHEXANE ACETATE
- CAS No.
- 4728-82-9
- Chemical Name:
- ALLYLCYCLOHEXANE ACETATE
- Synonyms
- ALLYLCYCLOHEXYLACETATE;ALLYLCYCLOHEXANE ACETATE;Cyclohexylacetic acid allyl ester;ALLYLCYCLOHEXANE ACETATE USP/EP/BP;Cyclohexaneacetic acid, 2-propenyl ester;Cyclohexaneacetic acid, 2-propen-1-yl ester
- CBNumber:
- CB7477580
- Molecular Formula:
- C11H18O2
- Molecular Weight:
- 182.26
- MDL Number:
- MFCD01745652
- MOL File:
- 4728-82-9.mol
Boiling point | 275.67°C (rough estimate) |
---|---|
Density | 0.9813 (rough estimate) |
refractive index | 1.4614 (estimate) |
FEMA | 2023 | ALLYL CYCLOHEXANEACETATE |
color | A colourless liquid. |
Odor | at 100.00 %. sweet ripe fruity pineapple green peach apricot |
Odor Type | fruity |
JECFA Number | 12 |
LogP | 3.59 |
Substances Added to Food (formerly EAFUS) | ALLYL CYCLOHEXANEACETATE |
FDA 21 CFR | 172.515 |
FDA UNII | M6J8835739 |
EPA Substance Registry System | Cyclohexaneacetic acid, 2-propenyl ester (4728-82-9) |
SAFETY
Risk and Safety Statements
Symbol(GHS) | GHS07 |
---|---|
Signal word | Warning |
Hazard statements | H315-H312-H302-H319 |
Precautionary statements | P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P |
Toxicity | The acute oral LD50 value in rats was reported as 0.90 g/kg (0.56-1.24 g/kg) (Moreno, 1974) and the acute dermal LD50 value in rabbits as 1.25 g/kg (0.35-2.15 g/kg) (Moreno, 1974). |
ALLYLCYCLOHEXANE ACETATE Chemical Properties,Uses,Production
Identification
Description
A liquid with an intense, sweet, long-lasting fruital (pineapple, peach, apricot) aroma. It is used as a flavor enhancer, flavoring agent and adjuvant.
Regulatory Status
CoE: n/a
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).
Usage
Reported uses (ppm): (FEMA, 1994)
Natural occurrence
Not reported found in nature.
Chemical Properties
Colorless liquid, almost insoluble in water, miscible with alcohol, essential oils and flavor chemicals, perfume materials, etc. Pronounced “mixed-fruity“ odor, sweet, lasting and less ethereal than the lower aliphatic acetates. The flavor is overall fruity (“tutti-frutti”) with some resemblance to Pineapple, Peach and Apricot.
Occurrence
Has apparently not been reported to occur in nature.
Preparation
By esterfication of cyclohexane, acetic acid and allyl alcohol in the presence of benzene
Taste threshold values
Taste characteristics at 15 ppm: pineapple with a sweet, ripe, fruity nuance.
Metabolism
The hydrolysis of ester linkages in foreign compounds may be catalysed by many different esterases; most of these have a low degree of substrate specificity and they are to be found in all animals and bacteria (Parke, 1968). In the rat, allyl acetate and allyl alcohol are metabolized to 3-hydroxypropylmercapturic acid, which is excreted in the urine (Clapp, Kaye & Young, 1969). In dogs, cyclohexylacetic acid was not aromatized and was probably completely oxidized in the body by β-oxidation (Bernhard, 1937; Williams, 1959).
ALLYLCYCLOHEXANE ACETATE Preparation Products And Raw materials
Supplier | Tel | Country | ProdList | Advantage | |
---|---|---|---|---|---|
Hubei Jusheng Technology Co.,Ltd. | 18871490254 | linda@hubeijusheng.com | CHINA | 28180 | 58 |
Dideu Industries Group Limited | +86-29-89586680 +86-15129568250 | 1026@dideu.com | China | 25247 | 58 |
BOC Sciences | 1-631-485-4226; 16314854226 | info@bocsci.com | United States | 14059 | 65 |
Shanghai wencai New Material Technology Co., Ltd. | 15721586846 | wencaimat@163.com | China | 2796 | 58 |
TCI (Shanghai) Chemical Trading Co., Ltd. | 021-021-61109150 | sales@tcisct.com | China | 31163 | 58 |
Baoji Didu Pharmaceutical and Chemical Co., Ltd | 029-61856358 15829046862 | 1035@dideu.com | China | 10011 | 58 |