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para-cresyl phenyl acetate

Chemical Structure

General Material Information

Preferred name para-cresyl phenyl acetate
Trivial Name p-Cresyl phenylacetate
Short Description p-tolyl phenylacetate
Formula C15 H14 O2
CAS Number 101-94-0
FEMA Number 3077
Flavis Number 9.709
ECHA Number 202-990-1
FDA UNII 959IBY0PDG
Nikkaji Number J62.863H
MDL MFCD00025983
COE Number 236
xLogP3-AA 3.60 (est)
Bio Activity Summary External link
NMR Predictor External link
JECFA Food Flavoring 705 p-tolyl phenylacetate
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 101-94-0 ; P-TOLYL PHENYLACETATE
Synonyms
  • acetic acid, phenyl-, p-tolyl ester
  • benzene acetic acid 4-methyl phenyl ester
  • benzene acetic acid 4-methylphenyl ester
  • benzeneacetic acid, 4-methylphenyl ester
  • p- cresyl a-toluate
  • cresyl a-toluate, p-
  • para- cresyl alpha-toluate
  • p- cresyl phenyl acetate
  • para- cresyl phenyl acetate
  • p- cresyl phenylacetate
  • para- cresyl phenylacetate
  • cresyl phenylacetate, p-
  • para- methyl phenyl alpha-toluate
  • 4-methyl phenyl benzene acetate
  • para- methyl phenyl phenyl acetate
  • 4-methylphenyl 2-phenylacetate
  • methylphenyl a-toluate, p-
  • p- methylphenyl alpha-toluate
  • para- methylphenyl alpha-toluate
  • 4-methylphenyl benzeneacetate
  • 4-methylphenyl phenylacetate
  • methylphenyl phenylacetate, p-
  • (4-methylphenyl) 2-phenylacetate
  • 4-methylphenylbenzene acetate
  • para- methylphenylphenyl acetate
  • 4-methylphenylphenylacetat
  • narcissin
  • phenyl acetic acid para-tolyl ester
  • phenylacetic acid p-cresyl ester
  • phenylacetic acid p-tolyl ester
  • phenylacetic acid, p-tolyl ester
  • tolyl a-toluate, p-
  • para- tolyl alpha-toluate
  • para- tolyl phenyl acetate
  • p- tolyl phenylacetate
  • para- tolyl phenylacetate
  • (4-methylphenyl) 2-phenylacetate
  • p-Cresyl α-toluate
  • p-Tolyl phenylacetate
  • p-Tolyl α-toluate
  • p-Cresyl phenylacetate
  • NSC 5981
  • p-Cresyl 2-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):HMDB41564
FooDB:FDB021553
Export Tariff Code:2916.39.7700
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 226.2749786377
Melting Point 74 to 76°C @ 760 mm Hg
Acid Value 1 max KOH/g
Vapor Pressure 0.0013 mmHg @ 20 °C
Flash Point TCC Value 110 °C TCC
logP (o/w) 3.79
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, 16.59 mg/L @ 25 °C (est) Yes
water No
Stability
non-discoloring in most media Unspecified

Organoleptic Properties

Odor Type: Animal
animal, rose, honey, narcissus, lily, hyacinth
Odor strength medium , recommend smelling in a 10.00 % solution or less
Substantivity 400 hour(s) at 20.00 % in dipropylene glycol
Luebke, William tgsc, (1983) At 10.00 % in dipropylene glycol. animal rose honey narcissus lily hyacinth
Flavor Type: Phenolic
phenolic, animal, floral, fecal, balsamic, narcissus
Luebke, William tgsc, (1983) Phenolic animal floral fecal balsamic narcissus
General comment Aromatic, balsamic, phenolic note

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)
Acute toxicity, Oral (Category 4), H302
GHS Label elements, including precautionary statements
Pictogramexclamation-mark.jpg
Signal word Warning
Hazard statement(s)
H302 - Harmful if swallowed
Precautionary statement(s)
P264 - Wash skin thouroughly after handling.
P270 - Do not eat, drink or smoke when using this product.
P301 + P312 - IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P330 - Rinse mouth.
P501 - Dispose of contents/ container to an approved waste disposal plant.
Human Experience:
4 % solution: no irritation or sensitization.
Oral/Parenteral Toxicity:
oral-rat LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 13, Pg. 775, 1975.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 13, Pg. 775, 1975.

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-cresyl phenyl acetate usage levels up to:
5.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.61 (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: 3
Click here to view publication 3
average usual ppmaverage maximum ppm
baked goods: -5.40000
beverages(nonalcoholic): -1.60000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -0.87000
fruit ices: -0.87000
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: --
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 58 (FGE.58) Consideration of phenol derivatives evaluated by JECFA (55th meeting) structurally related to ring substituted phenolic substances evaluated by EFSA in FGE.22 (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

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):101-94-0
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :60997
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
(4-methylphenyl) 2-phenylacetate
Chemidplus:0000101940
RTECS:CY1679750 for cas# 101-94-0