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eugenyl benzoate

Chemical Structure

General Material Information

Preferred name eugenyl benzoate
Trivial Name Eugenol benzoate
Short Description phenol, 4-allyl-2-methoxy-, benzoate
Formula C17 H16 O3
CAS Number 531-26-0
FEMA Number 2471
Flavis Number 9.766
ECHA Number 208-504-4
FDA UNII YRO21E9Z35
Nikkaji Number J60.348A
COE Number 636
xLogP3-AA 4.40 (est)
Bio Activity Summary External link
NMR Predictor External link
JECFA Food Flavoring 1533 eugenyl benzoate
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 531-26-0 ; EUGENYL BENZOATE
Synonyms
  • 4-allyl-2-methoxyphenyl benzoate
  • benzoyl eugenol
  • eugenol benzoate
  • p- eugenol, benzoate
  • 4-eugenyl benzoate
  • p- eugenyl benzoate
  • para- eugenyl benzoate
  • 2-methoxy-4-(2-propenyl) phenyl benzoate
  • 2-methoxy-4-(2-propenyl)phenyl benzoate
  • 2-methoxy-4-(prop-2-en-1-yl)phenyl benzoate
  • (2-methoxy-4-prop-2-enylphenyl) benzoate
  • phenol, 2-methoxy-4-(2-propenyl)-, benzoate
  • phenol, 2-methoxy-4-(2-propen-1-yl)-, benzoate
  • phenol, 4-allyl-2-methoxy-, benzoate
  • (2-methoxy-4-prop-2-enylphenyl) benzoate
  • Phenol, 2-methoxy-4-(2-propen-1-yl)-, 1-benzoate
  • Phenol, 2-methoxy-4-(2-propenyl)-, benzoate
  • 4-Allyl-2-methoxyphenyl benzoate
  • NSC 408913
  • 2-Methoxy-4-(prop-2-en-1-yl)phenyl benzoate

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

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Literature & References

(2-methoxy-4-prop-2-enylphenyl) benzoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:531-26-0
Pubchem (cid):62362
Pubchem (sid):135020175
Publications by Info
eugenol and related hydroxyallylbenzene derivatives

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):HMDB32056
FooDB:FDB008763
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 268.31213378906
Melting Point 69 to 70°C @ 760 mm Hg
Vapor Pressure 2.2E-5 mmHg @ 25 °C
Flash Point TCC Value 181.11 °C TCC
logP (o/w) 3.447 est
Solubility
alcohol Yes
water, 2.583 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Spicy
balsamic, clove, spicy
General comment At 100.00 %. mild balsam clove

Occurrences

Potential Uses

Applications
Odor purposes Balsam, Banana, Croton eluteria bark, Date, Pear
Flavoring purposes Croton eluteria bark
Other purposes Fixer

Safety Information

Safety information

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.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
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 eugenyl benzoate usage levels up to:
0.8000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.0024 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.90 (μg/capita/day)
Threshold of Concern:1800 (μg/person/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: 0.1300010.00000
beverages(nonalcoholic): 0.030000.13000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: 0.250002.00000
fruit ices: 0.250002.00000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 0.2500010.00000
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):

Flavouring Group Evaluation 60 (FGE.60): Consideration of eugenol and related hydroxyallylbenzene derivatives evaluated by JECFA (65th meeting) structurally related to ring- substituted phenolic substances evaluated by EFSA in FGE.22 (2006)
View page or View pdf

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):531-26-0
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :62362
National Institute of Allergy and Infectious Diseases:Data
(2-methoxy-4-prop-2-enylphenyl) benzoate
Chemidplus:0000531260