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para-anisyl phenyl acetate

Chemical Structure

General Material Information

Preferred name para-anisyl phenyl acetate
Trivial Name (4-Methoxyphenyl)methyl benzeneacetate
Short Description anisyl phenylacetate
Formula C16 H16 O3
CAS Number 102-17-0
FEMA Number 3740
Flavis Number 9.706
ECHA Number 203-010-5
FDA UNII 7475820557
Nikkaji Number J74.786F
Beilstein Number 5045439
MDL MFCD00053679
COE Number 233
NMR Predictor External link
JECFA Food Flavoring 876 anisyl phenylacetate
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 102-17-0 ; ANISYL PHENYLACETATE
Synonyms
  • acetic acid, phenyl-, p-methoxybenzyl ester
  • anisyl a-toluate
  • anisyl alpha-toluate
  • p- anisyl phenyl acetate
  • anisyl phenylacetate
  • p- anisyl phenylacetate
  • para- anisyl phenylacetate
  • benzene acetic acid (4-methoxyphenyl) methyl ester
  • benzeneacetic acid, (4-methoxyphenyl)methyl ester
  • 4-methoxybenzyl phenyl acetate
  • para- methoxybenzyl phenyl acetate
  • 4-methoxybenzyl phenylacetate
  • p- methoxybenzyl phenylacetate
  • 4-methoxybenzylphenyl acetate
  • (4-methoxyphenyl) methyl benzene acetic acid ester
  • (4-methoxyphenyl)methyl 2-phenylacetate
  • (4-methoxyphenyl)methyl benzeneacetate
  • phenyl acetic acid p-methoxybenzyl ester
  • phenyl acetic acid para-methoxybenzyl ester
  • phenylacetic acid, p-methoxybenzyl ester
  • (4-methoxyphenyl)methyl 2-phenylacetate
  • Benzyl alcohol, p-methoxy-, phenylacetate
  • (4-Methoxyphenyl)methyl benzeneacetate
  • p-Methoxybenzyl phenylacetate
  • 4-Methoxybenzyl phenylacetate

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
HMDB (The Human Metabolome Database):HMDB34992
FooDB:FDB013595
Export Tariff Code:2916.35.1500
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 256.30111694336
Specific gravity @ 25 °C
Pounds per Gallon 9.336 to 9.403
Refractive Index 1.552 to 1.56 @ 20 °C
Boiling Point 374 to 375°C @ 760 mm Hg
Acid Value 1 max KOH/g
Flash Point TCC Value 100 °C TCC
logP (o/w) 3.357 est
Solubility
alcohol Yes
water, 10.82 mg/L @ 25 °C (est) Yes

Organoleptic Properties

Odor Type: Anisic
anise, honey, balsamic, woody
Odor strength medium
Substantivity 48 hour(s) at 100.00 %
Luebke, William tgsc, (2006) At 100.00 %. anise honey balsam woody
Flavor Type: Anisic
anisic, balsamic, licorice, honey, powdery, medicinal
Luebke, William tgsc, (2006) Sweet anisic balsamic licorice honey powdery medicinal

Potential Uses

Applications
Odor purposes Amber, Floral, Hawthorn, Honey, Moss, Spice, Tobacco, Woody
Other purposes Fixer
Cosmetic purposes Perfuming agents

Safety Information

Safety information

Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 36/37/38 - Irritating to eyes, respiratory system, and skin.
S 02 - Keep out of the reach of children.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
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:
oral-rat LD50 > 5000 mg/kg
(Moreno, 1977ab)

gavage-rat LD50 [sex: M,F] M:5417.00 F:4641 mg/kg
(Reagan & Becci, 1984d)

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 18, Pg. 651, 1980.

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 para-anisyl phenyl acetate usage levels up to:
7.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.0024 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.10 (μg/capita/day)
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: 14
Click here to view publication 14
average usual ppmaverage maximum ppm
baked goods: -14.70000
beverages(nonalcoholic): -5.66000
beverages(alcoholic): -10.00000
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -6.16000
fruit ices: --
gelatins / puddings: -6.16000
granulated sugar: --
gravies: --
hard candy: --
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: -10.80000
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) on a request from the Commission related to Flavouring Group Evaluation 20 (FGE.20): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical group 23
View page or View pdf

Flavouring Group Evaluation 52 (FGE.52): Consideration of hydroxy- and alkoxy-substituted benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters evaluated by EFSA in FGE.20 (2005) (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)
View page or View pdf

Flavouring Group Evaluation 20, Revision 1 (FGE.20Rev1): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters from chemical group 23
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 20, Revision 2 (FGE.20Rev2): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical groups 23 and 30
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 20, Revision 3(FGE.20Rev3): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical groups 23 and 30
View page or View pdf

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):102-17-0
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :7599
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
(4-methoxyphenyl)methyl 2-phenylacetate
Chemidplus:0000102170
RTECS:AJ3000000 for cas# 102-17-0