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3-phenyl propyl cinnamate

General Material Information

Trivial Name 3-phenyl propyl cinnamate
Short Description 3-phenylpropyl cinnamate
Formula C18 H18 O2
CAS Number 122-68-9
CAS Number 290311-72-7
CAS Number 122-68-9 (Z)
FEMA Number 2894
Flavis Number 9.745
ECHA Number 204-565-6
FDA UNII F0Q8B0FS94
MDL MFCD00048269
COE Number 338
NMR Predictor External link
JECFA Food Flavoring 672 3-phenylpropyl cinnamate
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 122-68-9 ; 3-PHENYLPROPYL CINNAMATE
Synonyms
  • cinnamic acid 3-phenyl propyl ester
  • hydrocinnamyl 3-phenyl propenoate
  • hydrocinnamyl 3-phenylpropenoate
  • hydrocinnamyl cinnamate
  • 3-phenyl propyl 3-phenyl propenoate
  • 3-phenyl propyl 3-phenyl-2-propenoate
  • 3-phenyl propyl beta-phenyl acrylate
  • phenyl propyl cinnamate
  • 3-phenyl propyl cinnamate
  • beta- phenyl propyl cinnamate
  • 3-phenyl-2-propenoic acid 3-phenyl propyl ester
  • 3-phenylpropyl 3-phenyl-2-propenoate
  • 3-phenylpropyl 3-phenylacrylate
  • 3-phenylpropyl 3-phenylprop-2-enoate
  • 3-phenylpropyl 3-phenylpropenoate
  • 3-phenylpropyl cinnamate
  • 2-propenoic acid, 3-phenyl-, 3-phenylpropyl ester

US / EU / FDA / JECFA / FEMA / Scholar / Patents

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Other Information

(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
FDA Substances Added to Food (formerly EAFUS):View
CHEMBL:View
HMDB (The Human Metabolome Database):HMDB36387
FooDB:FDB015265
Export Tariff Code:2916.12.6000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 266.33987426758
Specific gravity @ 25 °C
Pounds per Gallon 8.937 to 8.953
Specific gravity @ 25 °C
Pounds per Gallon 8.937 to 8.987
Refractive Index 1.585 to 1.587 @ 20 °C
Refractive Index 1.583 to 1.588 @ 20 °C
Boiling Point 300 to 301°C @ 0 mm Hg
Acid Value 1 max KOH/g
Flash Point TCC Value 260.56 °C TCC
logP (o/w) 5.023 est
Solubility
alcohol Yes
benzyl benzoate Yes
water, 0.9383 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Balsamic
sweet, balsamic, spicy, apricot
Odor strength medium
Substantivity 400 hour(s) at 100.00 %
Luebke, William tgsc, (1988) At 100.00 %. sweet balsam spicy apricot
Flavor Type: Spicy
sweet, spicy, cinnamyl, balsamic, fruity
Luebke, William tgsc, (1988) Sweet spicy cinnamyl balsamic fruity

Occurrences

Safety Information

Safety information

Preferred SDS: View
European information :
Most important hazard(s):
None - None found.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Pictogram
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Human Experience:
4 % solution: no irritation or sensitization.
Oral/Parenteral Toxicity:
oral-rat LD50 > 5000 mg/kg
One group of 10 animals received 5000 mg/kg, mortality 0/10, only summary available.
(Keating, 1972d)

oral-rat LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 12, Pg. 969, 1974.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 12, Pg. 969, 1974.

Inhalation Toxicity:
Not determined

Safety in use information

Category:
flavor and fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for 3-phenyl propyl cinnamate usage levels up to:
4.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.49 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 37.00 (μg/capita/day)
Structure Class: I
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 3
Click here to view publication 3
average usual ppmaverage maximum ppm
baked goods: -5.30000
beverages(nonalcoholic): -3.40000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -4.10000
fruit ices: -4.10000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: -4.30000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --

Safety references

European Food Safety Athority(EFSA):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...

European Food Safety Authority (EFSA) reference(s):

Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to Flavouring Group Evaluation 15 (FGE.15): Aryl-substituted saturated and unsaturated primary alcohol/aldehyde/acid/ester derivatives from chemical group 22 (Commission Regulation (EC) No 1565/2000 of 18 July 2000)
View page or View pdf

Flavouring Group Evaluation 15, Revision 1 (FGE.15Rev1) - Aryl-substituted saturated and unsaturated primary alcohol/aldehyde/acid/ester derivatives from chemical group 22 - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 68 (FGE.68): Consideration of cinnamyl alcohol and related flavouring agents evaluated by JECFA (55th meeting) evaluated by EFSA in FGE.15Rev1 (2008)
View page or View pdf

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):122-68-9
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :61051
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
3-phenylpropyl 3-phenylprop-2-enoate
Chemidplus:0000122689
3-phenylpropyl (E)-3-phenylprop-2-enoate
3-phenylpropyl (Z)-3-phenylprop-2-enoate