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 |
|
Google Scholar | Start search |
Google Books | Start search |
Google Patents | Start search |
Perfumer & Flavorists | Start search |
EU Patents | Start search |
PubMeb | Start search |
NCBI | Start search |
(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 |
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 |
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 |
(data available) |
Applications | |
Odor purposes | Acacia , Apricot , Balsam , Benzoin absolute replacer , Eglantine , Floral , Geranium , Mimosa , Orris , Patchouli , Peru balsam , Reseda , Rose , Stephanotis , Violet |
Flavoring purposes | Benzoin absolute replacer , Chocolate cocoa |
Other purposes | Fixer |
Cosmetic purposes | Perfuming agents |
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 |
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 ppm | average 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: | - | - |
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 |