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

2-phenyl propyl acetate
hydratropic acetate

Supplier Sponsors

Name:2-phenylpropyl acetate
CAS Number: 10402-52-5Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:233-871-2
Nikkaji Web:J34.547D
MDL:MFCD00026344
XlogP3-AA:2.40 (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
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.01100 to 1.01900 @ 25.00 °C.
Pounds per Gallon - (est).: 8.413 to 8.479
Specific Gravity:1.01200 to 1.02000 @ 20.00 °C.
Pounds per Gallon - est.: 8.431 to 8.497
Refractive Index:1.49400 to 1.49800 @ 20.00 °C.
Boiling Point: 239.00 to 240.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.039000 mmHg @ 25.00 °C. (est)
Flash Point: 210.00 °F. TCC ( 98.89 °C. )
logP (o/w): 2.652 (est)
Soluble in:
 alcohol
 water, 157.2 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium
sweet hyacinth lilac green earthy
Odor Description:at 100.00 %. sweet hyacinth lilac green earthy
Luebke, William tgsc, (1992)
Odor sample from: International Flavors & Fragrances Inc.
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
BOC Sciences
For experimental / research use only.
Hydratropyl acetate 95%
Sigma-Aldrich: Aldrich
For experimental / research use only.
beta-Methylphenethyl Acetate
 
Safety Information:
Preferred SDS: View
 
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 4300 mg/kg
Food and Cosmetics Toxicology. Vol. 14, Pg. 797, 1976.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
flavor and fragrance agents
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for 2-phenyl propyl acetate usage levels up to:
  15.0000 % in the fragrance concentrate.
 
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):10402-52-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :25239
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
2-phenylpropyl acetate
Chemidplus:0010402525
 
References:
 2-phenylpropyl acetate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:10402-52-5
Pubchem (cid):25239
Pubchem (sid):134990964
 
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
CHEBI:View
KEGG (GenomeNet):C17665
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2915.39.9050
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
muguet undecadienal
FR
animal
para-
cresyl phenyl acetate
FL/FR
balsamic
bornyl formate
FL/FR
cinnamyl alcohol
FL/FR
2-
phenyl propyl alcohol
FL/FR
3-
phenyl propyl alcohol
FL/FR
caramellic
2-iso
butyl-3-methyl pyrazine
FL/FR
chemical
styralyl alcohol
FL/FR
citrus
tetrahydromyrcenol
FR
coconut
delta-
heptalactone
FL/FR
earthy
1-
nonen-3-ol
FL/FR
1-
octen-3-ol
FL/FR
fatty
(Z)-3-
octen-1-ol
FL/FR
fermented
hexanal diethyl acetal
FL/FR
floral
para-
anisaldehyde dimethyl acetal
FR
ethyl hydrocinnamate
FL/FR
geranium dihydropyran
FR
hawthorn ethanol
FR
hyacinth ether
FR
kewda oil
CS
(±)-
lilac aldehyde
FL/FR
lilac pentanol
FL/FR
linalool oxide
FL/FR
octyl acetate
FL/FR
phenethyl formate
FL/FR
phenethyl salicylate
FL/FR
phenyl acetaldehyde / methyl anthranilate schiff's base
FR
phenyl glycol diacetate
FR
2-
phenyl propionaldehyde dimethyl acetal
FL/FR
3-
phenyl propyl formate
FL/FR
phenyl propyl phenyl acetate
FR
3-
phenyl propyl propionate
FL/FR
(E)-2-
phenyl-1(2)-propene-1-yl acetate
FR
propiophenone
FL/FR
reseda acetal
FR
(R)-
styralyl alcohol
FL/FR
tea acetate
FR
(+)-alpha-
terpineol
FL/FR
tetrahydrolinalool
FL/FR
ylang ylang flower oil III
FL/FR
fruity
amyl formate
FL/FR
benzyl methyl ether
FL/FR
(Z)-3-
hexen-1-yl anthranilate
FL/FR
2-
pentyl furan
FL/FR
tropical trithiane
FL/FR
green
acetaldehyde ethyl phenethyl acetal
FL/FR
citrus carbaldehyde / methyl anthranilate schiff's base
FR
cumin acetaldehyde
FL/FR
alpha,alpha-
dimethyl benzyl alcohol
FL/FR
2,5-
dimethyl bicyclo(3.2.1)oct-2-ene
FR
ferula galbaniflua gum extract
FL/FR
galbanum resinoid replacer
FR
galbascone (IFF)
FR
geranium absolute
FL/FR
green ether
FL/FR
(Z)-3-
hepten-1-ol
FL/FR
heptyl cinnamate
FL/FR
(Z)-3-
hexen-1-yl acetoacetate
FL/FR
(Z)-3-
hexen-1-yl tiglate
FL/FR
hyacinth absolute
FL/FR
hyacinth butanal
FR
leafy acetal
FL/FR
octanal dimethyl acetal
FL/FR
phenoxyacetaldehyde 50% in benzyl alcohol
FR
phenyl acetaldehyde ethylene glycol acetal
FR
2-
phenyl propionaldehyde
FL/FR
1-
phenyl-2-pentanol
FL/FR
rose furan epoxide
FL/FR
2,4,8-
trimethyl-5-oxatricyclo(6.2.1.0*2,6*)undecane
FR
herbal
6-
hydroxydihydrotheaspirane (mixture of isomers)
FL/FR
methyl ortho-anisate
FL/FR
powdery
para-
anisyl alcohol
FL/FR
terpenic
(-)-alpha-
terpineol
FL/FR
alpha-
terpineol
FL/FR
waxy
octyl isobutyrate
FL/FR
For Flavor
No flavor group found for these
benzyl disulfide
FL
bornyl formate
FL/FR
alpha,alpha-
dimethyl benzyl alcohol
FL/FR
ethyl hydrocinnamate
FL/FR
(Z)-3-
hepten-1-ol
FL/FR
heptyl cinnamate
FL/FR
hexanal diethyl acetal
FL/FR
(Z)-3-
hexen-1-yl acetoacetate
FL/FR
hyacinth absolute
FL/FR
(±)-
lilac aldehyde
FL/FR
methyl ortho-anisate
FL/FR
3-
phenyl propyl formate
FL/FR
3-
phenyl propyl propionate
FL/FR
rose furan epoxide
FL/FR
(R)-
styralyl alcohol
FL/FR
(+)-alpha-
terpineol
FL/FR
(-)-alpha-
terpineol
FL/FR
aromatic
aromatic
leafy acetal
FL/FR
camphoreous
6-
hydroxydihydrotheaspirane (mixture of isomers)
FL/FR
chemical
styralyl alcohol
FL/FR
citrus
alpha-
terpineol
FL/FR
creamy
octyl isobutyrate
FL/FR
earthy
1-
nonen-3-ol
FL/FR
fatty
(Z)-3-
octen-1-ol
FL/FR
floral
(Z)-3-
hexen-1-yl anthranilate
FL/FR
tetrahydrolinalool
FL/FR
ylang ylang flower oil III
FL/FR
fruity
amyl formate
FL/FR
para-
anisyl alcohol
FL/FR
benzyl methyl ether
FL/FR
lilac pentanol
FL/FR
2-
phenyl propionaldehyde dimethyl acetal
FL/FR
1-
phenyl-2-pentanol
FL/FR
propiophenone
FL/FR
tropical trithiane
FL/FR
green
acetaldehyde ethyl phenethyl acetal
FL/FR
2-iso
butyl-3-methyl pyrazine
FL/FR
cinnamyl alcohol
FL/FR
cumin acetaldehyde
FL/FR
ferula galbaniflua gum extract
FL/FR
geranium absolute
FL/FR
green ether
FL/FR
(Z)-3-
hexen-1-yl tiglate
FL/FR
horseradish oil
FL
linalool oxide
FL/FR
octanal dimethyl acetal
FL/FR
2-
pentyl furan
FL/FR
phenethyl formate
FL/FR
2-
phenyl propionaldehyde
FL/FR
2-
phenyl propyl alcohol
FL/FR
propylene glycol acetone ketal
FL
lactonic
delta-
heptalactone
FL/FR
medicinal,
phenethyl salicylate
FL/FR
mushroom
1-
octen-3-ol
FL/FR
phenolic
para-
cresyl phenyl acetate
FL/FR
spicy
3-
phenyl propyl alcohol
FL/FR
waxy
octyl acetate
FL/FR
 
Potential Uses:
FRearth
FRhyacinth
FRjonquil
FRlilac
FRlily of the valley
FRnarcissus
FRtulip
FRviolet
FRwisteria
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 acetic acid 2-phenylpropyl ester
 hydratropic acetate
 hydratropyl acetate
1-methyl phenethyl acetate
beta-methyl phenyl ethyl acetate
2-phenyl propyl acetate
2-phenylpropyl acetate
2-phenylpropyl ethanoate
 
 
Notes:
None found
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