We have found 46587 results matching your criteria.
Please wait while we search...
  1. 1.
    General Material Information
  2. 2.
    PhysChem Properties
  3. 3.
    Occurrences
  4. 4.
    Organoleptic Properties
  5. 5.
    Suppliers
  6. 6.
    Potential Uses
  7. 7.
    Regulatory & Documentation
  8. 8.
    Safety Information
  9. 9.
    Other Information
  10. 10.
    Blenders & Components
  11. 11.
    Literature & References

phenethyl phenyl acetate

Chemical Structure

General Material Information

Preferred name phenethyl phenyl acetate
Trivial Name Phenylethyl phenylacetate
Short Description phenethyl phenylacetate
Formula C16 H16 O2
CAS Number 102-20-5
FEMA Number 2866
Flavis Number 9.707
ECHA Number 203-013-1
FDA UNII 5J5OJ7GH15
Nikkaji Number J74.787D
Beilstein Number 2214383
MDL MFCD00022049
COE Number 234
Bio Activity Summary External link
NMR Predictor External link
JECFA Food Flavoring 999 phenethyl phenylacetate
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 102-20-5 ; PHENETHYL PHENYLACETATE
Synonyms
  • benzene acetic acid 2-phenyl ethyl ester
  • benzeneacetic acid, 2-phenylethyl ester
  • benzyl carbinyl alpha-toluate
  • benzyl carbinyl phenyl acetate
  • phenethyl alpha-toluate
  • phenethyl phenyl acetate FCC
  • phenethyl phenylacetate
  • phenyl acetic acid phenethyl ester
  • phenyl acetic acid phenyl ethyl ester
  • 2-phenyl ethyl alpha-toluate
  • 2-phenyl ethyl benzene acetate
  • phenyl ethyl phenyl acetate
  • 2-phenyl ethyl phenyl acetate
  • beta- phenyl ethyl phenyl acetate
  • phenyl ethyl phenylacetate
  • phenyl ethyl phenylacetate natural
  • 2-phenylacetic acid 2-phenylethyl ester
  • 2-phenylethyl 2-phenylacetate
  • 2-phenylethyl 2-phenylethanoate
  • 2-phenylethyl a-toluate
  • 2-phenylethyl benzeneacetate
  • phenylethyl phenylacetate
  • 2-phenylethyl phenylacetate
  • phenylethyl phenylacetate natural
  • 2-phenylethyl 2-phenylacetate
  • Acetic acid, phenyl-, phenethyl ester
  • Benzylcarbinyl α-toluate
  • β-Phenylethyl phenylacetate
  • 2-Phenylethyl phenylacetate
  • NSC 6676
  • 2-Phenylethyl 2-phenylethanoate
  • Phenethyl 2-phenylacetate

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

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

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):HMDB35009
FooDB:FDB013613
Export Tariff Code:2916.35.1500
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex Yes
Molecular weight 240.30192565918
Specific gravity @ 25 °C
Pounds per Gallon 8.962 to 9.028
Specific gravity @ 20 °C
Pounds per Gallon 8.98 to 9.047
Refractive Index 1.547 to 1.552 @ 20 °C
Boiling Point 324 to 325°C @ 760 mm Hg
Boiling Point 177 to 178°C @ 5 mm Hg
Acid Value 1 max KOH/g
Vapor Pressure 2.3E-5 mmHg @ 25 °C
Flash Point TCC Value 100 °C TCC
logP (o/w) 3.933 est
Shelf life 24 months (or longer if stored properly.)
Storage notes Store in cool, dry place in tightly sealed containers, protected from heat and light.
Solubility
alcohol Yes
water, 5.921 mg/L @ 25 °C (est) Yes
Stability
alcoholic lotion Unspecified
antiperspirant Unspecified
deo stick Unspecified
detergent perborate Unspecified
fabric softener Unspecified
liquid detergent Unspecified
non-discoloring in most media Unspecified
shampoo Unspecified
soap Unspecified

Organoleptic Properties

Odor Type: Floral
floral, sweet, rose, honey, balsamic, green, fatty, powdery, cinnamyl
Odor strength medium
Substantivity 400 hour(s) at 20.00 % in dipropylene glycol
Luebke, William tgsc, (1984) At 100.00 %. floral sweet rose honey balsam
Mosciano, Gerard P&F 19, No. 1, 27, (1994) Honey, floral, sweet, rosy, green with fatty nuances, powdery and slightly cinnamic
Flavor Type: Honey
honey, floral, green, rose, cocoa, hay, tropical
Mosciano, Gerard P&F 19, No. 1, 27, (1994) At 25.00 ppm. Honey, floral, green, rose, cocoa, hay, tropical body
Useful in: brown cocoa, brown coffee, brown others, fruity red, fruity yellow, sweet others. Honey, sweet, fruity
General comment Honey floral green rose cocoa hay tropical

Occurrences

Safety Information

Safety information

Preferred SDS: View
European information :
Most important hazard(s):
Xi N - Irritant, Dangerous for the environment.
R 36/38 - Irritating to skin and eyes.
R 51/53 - Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
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.
S 61 - Avoid release to the environment. Refer to special instructions/safety data sheet.
Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
Skin irritation (Category 2), H315
Eye irritation (Category 2A), H319
GHS Label elements, including precautionary statements
Pictogramexclamation-mark.jpg
Signal word Warning
Hazard statement(s)
H315 - Causes skin irritation
H319 - Causes serious eye irritation
Precautionary statement(s)
P264 - Wash skin thouroughly after handling.
P280 - Wear protective gloves/protective clothing/eye protection/face protection.
P302 + P352 - IF ON SKIN: wash with plenty of soap and water.
P305 + P351 + P338 - IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
P332 + P313 - IF SKIN irritation occurs: Get medical advice/attention.
P337 + P313 - IF eye irritation persists: Get medical advice/attention.
P362 - Take off contaminated clothing and wash before reuse.
P501 - Dispose of contents/ container to an approved waste disposal plant.
Human Experience:
2 % solution: no irritation or sensitization.
Oral/Parenteral Toxicity:
gavage-rat LD50 [sex: M,F] 15390 mg/kg
(Jenner et al., 1964)

gavage-mouse LD50 [sex: M,F] 3190 mg/kg
(Zaitsev & Rakhmanina, 1974)

gavage-guinea pig LD50 [sex: M,F] 3190 mg/kg
(Zaitsev & Rakhmanina, 1974)

gavage-rat LD50 [sex: M,F] 3190 mg/kg
(Zaitsev & Rakhmanina, 1974)

oral-guinea pig LD50 3190 mg/kg
Voprosy Pitaniya. Problems of Nutrition. Vol. 33(5), Pg. 48, 1974.

oral-mouse LD50 3190 mg/kg
Voprosy Pitaniya. Problems of Nutrition. Vol. 33(5), Pg. 48, 1974.

oral-rat LD50 15000 mg/kg
BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964.

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 phenethyl phenyl acetate usage levels up to:
8.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU): 33.00 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 80.00 (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): -2.30000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -4.20000
fruit ices: -4.20000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: -4.80000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: -10.00000
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 14 (FGE.14): Phenethyl alcohol, aldehyde, esters, and related phenylacetic acid esters from chemical group 15 (Commission Regulation (EC) No 1565/2000 of 18 July 2000)
View page or View pdf

Flavouring Group Evaluation 53 (FGE.53): Consideration of phenethyl alcohol, aldehyde, acid and related acetals and esters evaluated by JECFA (59th meeting) structurally related to phenethyl alcohol, aldehyde, esters and related phenylacetic acid esters evaluated by EFSA in FGE.14 (2005) and one phenoxyethyl ester evaluated in FGE.23 (2006) (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 14, Revision 1 (FGE.14Rev1): Phenethyl alcohol, aldehyde, acetals, carboxylic acid and related esters from chemical group 15 and 22 [1] - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food
View page or View pdf

Flavouring Group Evaluation 53, Revision 1 (FGE.53Rev1): Consideration of phenethyl alcohol, aldehyde, acid and related acetals and esters evaluated by JECFA (59th meeting) FGE.23Rev1 (2008)
View page or View pdf

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):102-20-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :7601
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 3082
WGK Germany:2
2-phenylethyl 2-phenylacetate
Chemidplus:0000102205
RTECS:AJ3255000 for cas# 102-20-5