Allyl cyclohexyl propionate (CAS N° 2705-87-5)​

Photo credits: ScenTree SAS

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Allyl cyclohexyl propionate

Allyl 3-cyclohexyl propionate ; Allyl 3-cyclohexyl propanoate ; Allyl beta-cyclohexyl propionate ; Allyl beta-cyclohexyl propanoate ; Allyl cyclohexylpropanoate ; Allyl cyclohexylpropionate ; Allyl hexahydrophenylpropionate ; Allyl hexahydrophenylpropanoate ; Pineapple ester ; Prop-2-en-1-yl 3-cyclohexylpropionate ; Prop-2-en-1-yl 3-cyclohexylpropanoate ; 2-propenyl 3-cyclohexylpropanoate ; ACHP

Allyl cyclohexyl propionate (CAS N° 2705-87-5)​

Photo credits: ScenTree SAS

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Information Générales

General Presentation

  • CAS N° : 2705-87-5

  • EINECS number : 220-292-5

  • FEMA number : 2026

  • FLAVIS number : 09.498

  • JECFA number : 13

  • Appearance : Colorless liquid

  • Density : 0,95

  • Volatility : Head/Heart

  • Price Range : €€

Physico-chemical properties

  • Molecular formula : C12H20O2

  • Molecular Weight : 196,29 g/mol

  • Log P : 4,28

  • Fusion Point : <-20°C

  • Boiling Point : 266°C

  • Detection Threshold : Donnée indisponible.

  • Optical rotation : Donnée indisponible

  • Vapor pressure : Donnée indisponible

  • Refractive Index @20°C : Donnée indisponible

  • Acid Value : Donnée indisponible.

  • Flash Point : 106°C

Utilisation

Uses

Uses in perfumery :

Allyl Cyclohexyl Propionate is used in fruity notes of pineapple to bring a tasty, sweet, natural note and acidity of the fruit. It is more commonly used in exotic fruits notes and in chamomille reconstitutions.

Year of discovery :

Data not available.

Natural availability :

Allyl Cyclohexyl Propionate is not reported as found in nature. It can't be extracted and used as natural.

Isomerism :

Allyl Cyclohexyl Propionate is a constitutional isomer of Isobornyl acetate and Terpenyl acetate among others, but they do not have the same smell as ACHP.

Synthesis precursor :

Allyl Cyclohexyl Propionate is not used for the synthesis of another compound of olfactive interest.

Synthesis route :

Allyl Cyclohexyl Propionate is synthesized on a synthetical way in two steps, from Cinnamic Acid. The first step is a catalytic hydrogenation of the acid, at very high temperature (over 200°C), using a catalyst as palladium. The second step is an esterification involving the intermediary product, cyclohexyl propionic acid, and allyl alcohol, i.e. 2-propenol. This reaction is heated and uses an acidic catalysor as concentrated sulfuric acid.

Utilisation

Regulations & IFRA

Allergens :

This ingredient does not contain any allergen.

IFRA 51th :

This ingredient is restricted by the 51th amendment

    IFRA's logo
  • Restriction type : RESTRICTION_SPECIFICATION

  • Cause of restriction : DERMAL SENSITIZATION AND SYSTEMIC TOXICITY

  • Amendment : 51

Quantitative limit on the use :
Cat.1 Cat.2 Cat.3 Cat.4
Cat.5
A B C D
Cat.6
0,085 % 0,025 % 0,35 % 0,47 %
0,12 % 0,12 % 0,12 % 0,040 %
0,28 %
Cat.5
A B C D
Cat.6
0,12 % 0,12 % 0,12 % 0,040 %
0,28 %
Cat.7
A B
Cat.8 Cat.9
Cat.10
A B
Cat.11
A B
Cat.12
0,70 % 0,70 %
0,040 % 0,92 %
0,7 % 3,3 %
0,040 % 0,040 %
No restriction
Cat.10
A B
Cat.11
A B
Cat.12
0,7 % 3,3 %
0,040 % 0,040 %
No restriction
  • Specified ingredients: notes
    According to the IFRA Specification Standard of Allyl esters, Allyl esters should only be used when the level of free Allylalcohol in the ester is less than 0.1%. This recommendation is based on the delayed irritant potential of Allylalcohol. Please also refer to the IFRA Specification Standard Allyl esters.

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