EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

3-phenyl propyl acetate
3-phenylpropyl acetate

Sponsors

Fragrance Demo Formulas
Name:3-phenylpropyl acetate
CAS Number: 122-72-5Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:204-569-8
FDA UNII:AKW166708I
Nikkaji Web:J5.534D
Beilstein Number:0744307
MDL:MFCD00026216
CoE Number:222
XlogP3:2.50 (est)
Molecular Weight:178.23098000
Formula:C11 H14 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
Category:flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
JECFA Food Flavoring:638 3-phenylpropyl acetate
FLAVIS Number:09.032 (Old)
DG SANTE Food Flavourings:09.032 3-phenylpropyl acetate
FEMA Number:2890 3-phenylpropyl acetate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm: 3-PHENYLPROPYL ACETATE
FDA Regulation:
FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION
Subpart F--Flavoring Agents and Related Substances
Sec. 172.515 Synthetic flavoring substances and adjuvants.
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: Yes
Specific Gravity:1.01200 to 1.01600 @ 25.00 °C.
Pounds per Gallon - (est).: 8.421 to 8.454
Specific Gravity:1.01200 to 1.02000 @ 20.00 °C.
Pounds per Gallon - est.: 8.431 to 8.497
Refractive Index:1.49400 to 1.50000 @ 20.00 °C.
Boiling Point: 244.00 to 245.00 °C. @ 760.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure:0.011000 mm/Hg @ 25.00 °C. (est)
Flash Point:> 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w): 2.847 (est)
Soluble in:
 alcohol
 water, 136 mg/L @ 25 °C (est)
Insoluble in:
 water
Stability:
 cream
 hair spray
 lotion
 non-discoloring in most media
 powder
 soap
 
Organoleptic Properties:
Odor Type: balsamic
Odor Strength:medium
Substantivity:268 hour(s) at 100.00 %
sweet balsamic storax spicy cinnamon
Odor Description:at 100.00 %. sweet balsam storax spicy cinnamon
Luebke, William tgsc, (1985)
Odor sample from: Givaudan Corporation
balsamic spicy cinnamyl fruity honey hay
Odor Description:Balsamic, spicy, cinnamic and fruity with honey and hay-like nuances
Mosciano, Gerard P&F 20, No. 6, 49, (1995)
Flavor Type: balsamic
balsamic floral fruity sappy spicy cinnamyl powdery
Taste Description: at 10.00 ppm. Balsamic, floral, fruity, sappy, spicy and cinnamic with powdery nuances
Mosciano, Gerard P&F 20, No. 6, 49, (1995)
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Advanced Biotech
PHENYL PROPYL ACETATE NATURAL
Alfrebro
3-PHENYL PROPYL ACETATE NATURAL
Odor: Spicy, Floral
Aurochemicals
PHENYL PROPYL ACETATE, Natural
Berjé
Phenyl Propyl Acetate
Happening at Berje
BOC Sciences
For experimental / research use only.
3-Phenylpropyl Acetate 95%
Citrus and Allied Essences
Phenyl Propyl Acetate FCC, kosher
Market Report
ECSA Chemicals
Phenyl-3-propyl Acetate
Company Profile
EMD Millipore
For experimental / research use only.
3-Phenylpropyl Acetate
Grau Aromatics
PHENYL-3-PROPYL-ACETATE
NI, Kosher
Indukern F&F
PHENYL PROPYL ACETATE
Odor: BALSAMIC, SWEET, FLORAL, SPICY
Inoue Perfumery
3-PHENYLPROPYL ACETATE
Lluch Essence
3-PHENYL PROPYL ACETATE
Miltitz Aromatics
3-PHENYLPROPYL ACETATE FCC
min. 98 %
Odor: Warm and mildly balsamic, floral, spicy, cinnamic with hay and tobacco nuances
Use: 3-PHENYLPROPYL ACETATE is used in perfume compositions as a modifier in hyacinth, rose, oriental bases, lilac and lily, reseda etc. and it blends well with the rose alcohols, the linalol family, styrax and ylang, labdanum salicylates etc.
Flavor: Balsamic floral fruity, spicy and cinnamic with powdery nuances
It is used in spice, fruit complexes and in honey and tobacco flavors.
Moellhausen
ACETATO 3-FENIL PROPILE
Penta International
3-PHENYLPROPYL ACETATE NATURAL, Kosher
Penta International
3-PHENYLPROPYL ACETATE, Kosher
Reincke & Fichtner
3-Phenylpropyl Acetate
Sigma-Aldrich
3-Phenylpropyl acetate, ≥98%, FCC, FG
Odor: spicy; floral; fruity; sweet
Certified Food Grade Products
SRS Aromatics
3-PHENYL PROPYL ACETATE FCC
Odor: Balsamic, Spicy, Cinnamic, Fruity, Honey, Hay
TCI AMERICA
For experimental / research use only.
3-Phenylpropyl Acetate >98.0%(GC)
Treatt
Phenyl Propyl Acetate
Vigon International
Phenyl Propyl Acetate FCC
 
Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
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.
Human Experience:
8 % solution: no irritation or sensitization.
Oral/Parenteral Toxicity:
oral-rat LD50 4700 mg/kg
Confidence limits of 3840-5560 mg/kg bw, 4 dose groups (2220-7500 mg/kg bw) of 10 animals, only summary available.
(Moreno, 1973j)

oral-rat LD50 4700 mg/kg
Food and Cosmetics Toxicology. Vol. 12, Pg. 965, 1974.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 12, Pg. 965, 1974.

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for 3-phenyl propyl acetate usage levels up to:
  15.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 35.00 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 9.00 (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
 average usual ppmaverage maximum ppm
baked goods: -6.30000
beverages(nonalcoholic): -3.20000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: -10.00000
condiments / relishes: -0.10000
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -4.80000
fruit ices: -4.80000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: -4.60000
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):

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
EPA Substance Registry Services (TSCA):122-72-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :31226
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
3-phenylpropyl acetate
Chemidplus:0000122725
RTECS:UB9000000 for cas# 122-72-5
 
References:
 3-phenylpropyl acetate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:122-72-5
Pubchem (cid):31226
Pubchem (sid):134974049
Pherobase:View
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
FDA Everything Added to Food in the United States (EAFUS):View
CHEBI:View
KEGG (GenomeNet):C17663
HMDB (The Human Metabolome Database):HMDB33386
FooDB:FDB011417
Export Tariff Code:2915.39.3500
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
amber
labdanum oil
FL/FR
balsamic
artemisia annua herb oil bulgaria
FL/FR
sumatra
benzoin absolute
FL/FR
sumatra
benzoin resinoid
FL/FR
benzyl cinnamate
FL/FR
alpha-
bisabolene
FL/FR
iso
butyl cinnamate
FL/FR
cinnamic acid
FL/FR
cinnamyl alcohol
FL/FR
cinnamyl alcohol replacer
FR
cinnamyl benzoate
FL/FR
(E)-
cinnamyl butyrate
FL/FR
cinnamyl butyrate
FL/FR
cinnamyl cinnamate
FL/FR
copaiba balsam oil
FL/FR
ethyl cinnamate
FL/FR
frankincense absolute
FL/FR
(Z)-3-
hexen-1-yl cinnamate
FR
hexyl cinnamate
FR
linalyl cinnamate
FL/FR
alpha-
methyl cinnamyl alcohol
FR
myrrh oil CO2 extract
FL/FR
myrrh resinoid
FR
octyl cinnamate
FR
opoponax oil (balsamodendron kafal)
FL/FR
opoponax oil (commiphora erythraea var. glabrescens engle)
FL/FR
opoponax resinoid (balsamodendron kafal)
FR
peru balsam oil
FL/FR
peru balsam resinoid
FL/FR
2-
phenoxyethyl formate
FR
3-
phenyl propyl cinnamate
FL/FR
black
poplar bud oleoresin
FL/FR
propyl cinnamate
FL/FR
tetrahydrofurfuryl cinnamate
FL/FR
tolu balsam oil
FL/FR
annus
wormwood oil france
FL/FR
caramellic
immortelle absolute
FL/FR
mesitene lactone
FR
earthy
pinus sylvestris leaf absolute
FL/FR
floral
citronellyl anthranilate
FL/FR
3,6-
dimethyl-3-octyl acetate
FR
ethyl hydrocinnamate
FL/FR
(E)-
geranyl acetone
FL/FR
geranyl phenyl acetate
FL/FR
iso
jasmone
FL/FR
iso
jasmone
FL/FR
(Z)-
methyl epi-jasmonate
FL/FR
alpha-iso
methyl ionone (70% min.)
FL/FR
alpha-iso
methyl ionone (80% min.)
FL/FR
methyl jasmonate
FL/FR
mimosa absolute
FL/FR
mimosa absolute france
FL/FR
mimosa absolute india
FL/FR
(E)-
nerolidol
FL/FR
neryl isovalerate
FL/FR
bitter
orangeflower absolute morocco
FL/FR
osmanthus concrete
FL/FR
papaya isobutyrate
FL/FR
phenethyl acetate
FL/FR
phenethyl butyrate
FL/FR
phenethyl hexanoate
FL/FR
phenethyl propionate
FL/FR
rose butanoate
FL/FR
tilia cordata flower oil CO2 extract
FR
fruity
bisabolene
FL/FR
ethyl methyl-para-tolyl glycidate
FL/FR
linalyl isobutyrate
FL/FR
methyl nonane dione
FL/FR
neryl propionate
FL/FR
vanilla carboxylate
FL/FR
xanthoxylum fruit oil
FR
green
acetaldehyde ethyl phenethyl acetal
FL/FR
leafy acetal
FL/FR
neryl butyrate
FL/FR
phenyl acetaldehyde dimethyl acetal
FL/FR
3-
phenyl propionaldehyde
FL/FR
herbal
hop oil
FL/FR
(1S,5R)-
myrtenyl acetate
FL/FR
honey
allyl phenyl acetate
FL/FR
methyl hydrocinnamate
FL/FR
methyl phenyl acetate
FL/FR
minty
ethyl salicylate
FL/FR
spicy
amyl isoeugenol
FR
bay leaf oil terpeneless
FL/FR
benzyl isoeugenol
FL/FR
cinnamyl acetate
FL/FR
(Z)-
cinnamyl acetate
FL/FR
clove bud oleoresin
FL/FR
eugenyl benzoate
FL/FR
mace oil CO2 extract
FL/FR
alpha-
methyl cinnamaldehyde
FL/FR
myrcene
FR
nutmeg absolute
FL/FR
nutmeg oil CO2 extract
FL/FR
spicy acetoacetate
FL/FR
annus
wormwood oil vietnam
FL/FR
terpenic
cypress leaf oil
FR
tonka
dihydrocoumarin replacer
FR
tonka undecanone
FR
waxy
dihydrocitronellyl acetate
FL/FR
methyl butyl phenyl acetate
FL/FR
woody
agarwood specialty
FR
bruyere root absolute
FR
cycloionone
FL/FR
guaiacwood oil 20% in gurjun balsam oil
FR
kaempferia galanga rhizome oil
FL/FR
sandalwood oil
FL/FR
woody octene
FR
For Flavor
No flavor group found for these
artemisia annua herb oil bulgaria
FL/FR
alpha-
bisabolene
FL/FR
cinnamic acid
FL/FR
(Z)-
cinnamyl acetate
FL/FR
cinnamyl benzoate
FL/FR
(E)-
cinnamyl butyrate
FL/FR
dihydrocitronellyl acetate
FL/FR
ethyl hydrocinnamate
FL/FR
eugenyl benzoate
FL/FR
geranyl phenyl acetate
FL/FR
methyl furfuracrylate
FL
methyl hydrocinnamate
FL/FR
methyl nonane dione
FL/FR
pinus sylvestris leaf absolute
FL/FR
black
poplar bud oleoresin
FL/FR
tetrahydrofurfuryl cinnamate
FL/FR
annus
wormwood oil france
FL/FR
amber
amber
labdanum oil
FL/FR
aromatic
leafy acetal
FL/FR
balsamic
sumatra
benzoin resinoid
FL/FR
iso
butyl cinnamate
FL/FR
copaiba balsam oil
FL/FR
ethyl cinnamate
FL/FR
myrrh oil CO2 extract
FL/FR
opoponax oil (balsamodendron kafal)
FL/FR
opoponax oil (commiphora erythraea var. glabrescens engle)
FL/FR
peru balsam oil
FL/FR
peru balsam resinoid
FL/FR
tolu balsam oil
FL/FR
camphoreous
kaempferia galanga rhizome oil
FL/FR
citrus
bisabolene
FL/FR
floral
(E)-
geranyl acetone
FL/FR
linalyl isobutyrate
FL/FR
(Z)-
methyl epi-jasmonate
FL/FR
alpha-iso
methyl ionone (70% min.)
FL/FR
alpha-iso
methyl ionone (80% min.)
FL/FR
methyl jasmonate
FL/FR
methyl phenyl acetate
FL/FR
bitter
orangeflower absolute morocco
FL/FR
phenethyl propionate
FL/FR
fruity
citronellyl anthranilate
FL/FR
ethyl methyl-para-tolyl glycidate
FL/FR
linalyl cinnamate
FL/FR
methyl 4-phenyl butyrate
FL
neryl isovalerate
FL/FR
osmanthus concrete
FL/FR
phenethyl butyrate
FL/FR
propyl cinnamate
FL/FR
rose butanoate
FL/FR
vanilla carboxylate
FL/FR
green
acetaldehyde ethyl phenethyl acetal
FL/FR
cinnamyl alcohol
FL/FR
(E)-3-
hexenoic acid
FL
immortelle absolute
FL/FR
iso
jasmone
FL/FR
iso
jasmone
FL/FR
(E)-
nerolidol
FL/FR
neryl butyrate
FL/FR
neryl propionate
FL/FR
papaya isobutyrate
FL/FR
phenyl acetaldehyde dimethyl acetal
FL/FR
3-
phenyl propionaldehyde
FL/FR
herbal
hop oil
FL/FR
honey
allyl phenyl acetate
FL/FR
phenethyl acetate
FL/FR
leafy
methyl butyl phenyl acetate
FL/FR
medicinal
frankincense absolute
FL/FR
minty
ethyl salicylate
FL/FR
nutty
2-
acetyl-1-methyl pyrrole
FL
furfural acetone
FL
spicy
bay leaf oil terpeneless
FL/FR
sumatra
benzoin absolute
FL/FR
benzyl cinnamate
FL/FR
benzyl isoeugenol
FL/FR
benzylidene acetone
FL
cinnamyl acetate
FL/FR
cinnamyl cinnamate
FL/FR
clove bud oleoresin
FL/FR
galangal root oleoresin
FL
mace oil CO2 extract
FL/FR
alpha-
methyl cinnamaldehyde
FL/FR
nutmeg absolute
FL/FR
nutmeg oil CO2 extract
FL/FR
3-
phenyl propyl cinnamate
FL/FR
spicy acetoacetate
FL/FR
annus
wormwood oil vietnam
FL/FR
waxy
mimosa absolute
FL/FR
mimosa absolute france
FL/FR
mimosa absolute india
FL/FR
phenethyl hexanoate
FL/FR
winey
cinnamyl butyrate
FL/FR
woody
cycloionone
FL/FR
(1S,5R)-
myrtenyl acetate
FL/FR
sandalwood oil
FL/FR
 
Potential Uses:
FRapple
FRbalsam
FRblackberry
FRblueberry
FRcassia
FRcherry
 chocolate cocoa
FRchypre
FRcinnamon
FRcranberry
FRcurrant black currant
FRfruit
FRgeranium
FRgooseberry
FRgrape
FRheather
FRheliotrope
FRhuckleberry
FRhyacinth
FRincense
FRjasmin
FRlilac
FRlily
FRlily of the valley
FRmagnolia
FRnarcissus
FRoriental
FRplum
FRreseda
FRrose
FRrose red rose
FRrose white rose
FRspice
FRvanilla
FRwallflower
FRwoody
 
Occurrence (nature, food, other):note
 cantaloupe petiole
Search Trop Picture
 cassia plant
Search Trop Picture
 champaca concrete @ 0.05%
Data GC Search Trop Picture
 cinnamon ceylon cinnamon bark
Search Trop Picture
 cinnamon ceylon cinnamon plant
Search Trop Picture
 cinnamon fruit oil india @ 2.9-4.3%
Data GC Search Trop Picture
 guava fruit headspace reunion @ 0.30%
Data GC Search Trop Picture
 guava fruit oil reunion @ 5.40%
Data GC Search Trop Picture
 hyacinthus orientalis absolute @ 0.05-0.06%
Data GC Search Trop Picture
 laurel leaf oil turkey @ 0.10%
Data GC Search Trop Picture
 narcissus
Search Trop Picture
 narcissus absolute @ 1.83%
Data GC Search Trop Picture
 rum
Search PMC Picture
 
Synonyms:
 acetato 3-fenil propile
 acetic acid 3-phenylpropyl ester
3-acetoxy-1-phenyl propane
3-acetoxy-1-phenylpropane
1-acetoxy-3-phenyl propane
1-acetoxy-3-phenylpropane
(3-acetoxypropyl) benzene
(3-acetoxypropyl)benzene
 benzene propanol acetate
 benzenepropanol acetate
 benzenepropanol, acetate
 benzenepropyl acetate
 dihydrocinnamic acetate
 hydrocinnamyl acetate
 phenyl propyl acetate
3-phenyl propyl acetate
beta-phenyl propyl acetate
 phenyl propyl acetate FCC
3-phenyl-1-propanol acetate
3-phenyl-1-propanol, acetate
3-phenyl-1-propyl acetate
 phenyl-3-propyl-acetate
3-phenylpropyl acetate
3-phenylpropyl acetate FCC
3-phenylpropyl acetate natural
1-propanol, 3-phenyl-, acetate
 
 
Notes:
Blends well with rose alcohols. Modifier in hyacinth. Flavouring ingredient. Present in guava fruit and peel, melon, rum and cassia leaf
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