(E)-2-phenyl-1(2)-propene-1-yl acetate
bigaflor
 
Notes:
None found
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CAS Number: 37973-51-6Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 253-735-6
Nikkaji Web: J261.278J
XlogP3-AA: 2.70 (est)
Molecular Weight: 176.21504000
Formula: C11 H12 O2
NMR Predictor: Predict (works with chrome or firefox)
Category: fragrance agents
 
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Physical Properties:
Appearance: pale yellow clear liquid (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 1.04700 @  25.00 °C.
Refractive Index: 1.53200 to 1.53500 @  20.00 °C.
Boiling Point: 95.00 °C. @ 2.00 mm Hg
Boiling Point: 249.00 to  250.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.023000 mmHg @ 25.00 °C. (est)
Flash Point: > 200.00 °F. TCC ( > 93.33 °C. )
logP (o/w): 2.622 (est)
Soluble in:
 alcohol
 water, 190.1 mg/L @ 25 °C (est)
Insoluble in:
 water
Stability:
 acids
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Organoleptic Properties:
 
Odor Type: floral
 
Odor Strength: medium
 
 sweet  honey  neroli  hyacinth  
Odor Description:
at 100.00 %. 
sweet honey neroli hyacinth
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
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Suppliers:
 None found
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Safety Information:
 
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-mouse LD50  1700 mg/kg

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: fragrance agents
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for (E)-2-phenyl-1(2)-propene-1-yl acetate usage levels up to:
  5.0000 % in the fragrance concentrate.
 
Recommendation for (E)-2-phenyl-1(2)-propene-1-yl acetate flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 37973-51-6
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 2753159
National Institute of Allergy and Infectious Diseases: Data
 [(E)-2-phenylprop-1-enyl] acetate
Chemidplus: 0037973516
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References:
 [(E)-2-phenylprop-1-enyl] acetate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 37973-51-6
Pubchem (cid): 2753159
Pubchem (sid): 135118378
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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
HMDB (The Human Metabolome Database): Search
Export Tariff Code: 2915.39.9050
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
acidic
 cyclohexyl acetic acidFL/FR
aldehydic
 citronellyl oxyacetaldehydeFL/FR
 muguet undecadienalFR
animal
para-cresyl phenyl acetateFL/FR
1,2,3,4-tetrahydroquinolineFR
anisic
para-anisyl phenyl acetateFL/FR
balsamic
 brachyleana hutchinsii wood oilFR
 cinnamyl alcoholFL/FR
 guaiacyl phenyl acetateFL/FR
3-phenyl propyl alcoholFL/FR
2-phenyl propyl alcoholFL/FR
caramellic
 immortelle absoluteFL/FR
 propyl pyruvateFL/FR
cereal
 bran absoluteFR
chemical
 styralyl alcoholFL/FR
chocolate
isoamyl phenyl acetateFL/FR
 cocoa pentenalFL/FR
citrus
 citral / methyl anthranilate schiff's baseFR
(Z)-4-decenalFL/FR
2-heptanolFL/FR
alpha-terpinyl methyl etherFL/FR
clean
 clean nitrileFR
coumarinic
 tonka ketoneFR
dairy
 methyl butyl phenyl acetateFL/FR
fatty
 methyl (E)-2-hexenoateFL/FR
 undecanal propylene glycol acetalFL/FR
fermented
 hexanal diethyl acetalFL/FR
floral
 cardamom absoluteFL/FR
 champaca absoluteFR
 citronellyl isovalerateFL/FR
 citronellyl phenyl acetateFL/FR
 citronellyl valerateFL/FR
 cyclamen aldehyde / methyl anthranilate schiff's baseFR
 cyclohexyl phenyl acetateFR
 decanal / methyl anthranilate schiff's baseFR
 decyl formateFR
 ethyl anthranilateFL/FR
 ethyl hydrocinnamateFL/FR
 ethyl phenyl acetateFL/FR
 genet concreteFR
 geranyl anthranilateFR
 geranyl phenyl acetateFL/FR
 heliotropyl diethyl acetalFR
 honeysuckle absoluteFR
 honeysuckle fragranceFR
 honeysuckle specialtyFR
 hyacinth acetalsFL/FR
 hyacinth etherFR
 hydroxycitronellal / methyl anthranilate schiff's baseFR
 leerall / methyl anthranilate schiff's baseFR
 lilac specialtyFR
 lilyall / methyl anthranilate schiff's baseFR
 linalyl anthranilateFL/FR
 linalyl phenyl acetateFL/FR
ortho-methyl acetophenoneFL/FR
beta-naphthyl methyl ketoneFL/FR
alpha-naphthyl methyl ketoneFL/FR
 neroli oil bigardeFL/FR
 neroli oil CO2 extractFL/FR
 nerolin fragarolFL/FR
 nonanal / methyl anthranilate schiff's baseFR
 ocean propanal / methyl anthranilate schiff's baseFR
 octyl isovalerateFL/FR
 orange blossom fragranceFR
 orange flower specialtyFR
bitter orangeflower absolute moroccoFL/FR
bitter orangeflower concrete moroccoFR
 petitgrain bigarade oilFL/FR
 phenethyl acetateFL/FR
 phenethyl anthranilateFL/FR
 phenethyl benzoateFL/FR
 phenethyl formateFL/FR
 phenethyl hexanoateFL/FR
 phenethyl lactateFL/FR
 phenethyl phenyl acetateFL/FR
 phenethyl propionateFL/FR
 phenethyl salicylateFL/FR
 phenyl acetaldehyde / methyl anthranilate schiff's baseFR
 phenyl acetaldehyde 2,3-butylene glycol acetalFL/FR
 phenyl glycol diacetateFR
(S)-2-phenyl propionaldehydeFL/FR
2-phenyl propionaldehyde dimethyl acetalFL/FR
2-phenyl propyl acetateFL/FR
(R)-2-phenyl propyl alcoholFL/FR
3-phenyl propyl formateFL/FR
 phenyl propyl phenyl acetateFR
3-phenyl propyl propionateFL/FR
2-phenyl-2-pentenalFL/FR
 propyl anthranilateFL/FR
isopropyl anthranilateFL/FR
isopropyl phenyl acetateFL/FR
 reseda acetalFR
 rhodinyl phenyl acetateFL/FR
 rose absolute (rosa centifolia) moroccoFL/FR
 rose carboxylateFR
 rose concrete (rosa centifolia)FR
 surfleurs d'oranger oilFL/FR
 tea acetateFR
alpha-terpinyl anthranilateFL/FR
 tuberose absolute (from concrete)FL/FR
 tuberose absolute (from pommade)FL/FR
 wallflower absoluteFR
fruity
 allyl phenoxyacetateFL/FR
 benzyl methyl etherFL/FR
isobutyl anthranilateFL/FR
 cyclohexyl anthranilateFL/FR
 cyclohexyl crotonateFR
beta-damasconeFL/FR
(Z)-beta-damasconeFL/FR
(E)-beta-damasconeFL/FR
 methyl anthranilateFL/FR
(Z)-3-octen-1-yl propionateFL/FR
 osmanthus flower absoluteFL/FR
 strawberry glycidate 1 (aldehyde C-16 (so-called))FL/FR
 strawberry glycidate 2FL/FR
green
 acetaldehyde ethyl phenethyl acetalFL/FR
 citrus carbaldehyde / methyl anthranilate schiff's baseFR
 galbascone (IFF)FR
 green etherFL/FR
 heptyl cinnamateFL/FR
(E)-2-hexen-1-yl phenyl acetateFL/FR
 hexoxyacetaldehyde dimethyl acetalFR
 hyacinth absoluteFL/FR
 hyacinth butanalFR
 leafy acetalFL/FR
4-methyl-4-phenyl pentanoneFR
 nerol oxideFL/FR
(Z,Z)-3,6-nonadien-1-olFL/FR
 octyl oxyacetaldehydeFR
 phenoxyacetaldehyde 50% in benzyl alcoholFR
 phenyl acetaldehydeFL/FR
 phenyl acetaldehyde ethylene glycol acetalFR
 phenyl acetaldehyde solutionFL/FR
2-phenyl propionaldehydeFL/FR
hay
 beeswax absoluteFL/FR
herbal
 artemisyl ketoneFL/FR
american elder flower absoluteFR
 matricaria chamomilla flower oilFL/FR
 methyl ortho-anisateFL/FR
honey
 allyl phenyl acetateFL/FR
 butyl phenyl acetateFL/FR
 methyl hydrocinnamateFL/FR
 methyl phenyl acetateFL/FR
 phenethyl furoateFL/FR
 phenyl acetic acidFL/FR
 phenyl pyruvic acidFL/FR
 propyl phenyl acetateFL/FR
melon
(Z)-6-nonen-1-olFL/FR
musk
 musk gx 100%FR
 musk gx 50% in BBFR
 musk gx 50% in DEPFR
 musk gx 50% in IPMFR
musty
 cocoa butenalFL/FR
naphthyl
beta-naphthyl ethyl etherFL/FR
beta-naphthyl methyl etherFL/FR
powdery
para-anisyl alcoholFL/FR
spicy
 bubble gum fragranceFR
 carnation absoluteFR
 eugenyl phenyl acetateFL/FR
isoeugenyl phenyl acetateFL/FR
(E)-para-methoxycinnamaldehydeFL/FR
terpenic
(E,E)-2,6-alloocimeneFL/FR
thujonic
 cistus cyclohexanoneFL/FR
waxy
 dihydrocitronellyl acetateFL/FR
1-dodecanolFL/FR
 waxy acetateFR
woody
 labdanum ethanoneFR
 santalyl phenyl acetateFL/FR
4,6,11-trimethyl-5-oxatricyclo(6.2.2.0*4,9*)dodec-6-eneFR
 
For Flavor
 
No flavor group found for these
 artemisyl ketoneFL/FR
 cistus cyclohexanoneFL/FR
 citronellyl isovalerateFL/FR
 citronellyl valerateFL/FR
 dihydrocitronellyl acetateFL/FR
 ethyl hydrocinnamateFL/FR
 eugenyl phenyl acetateFL/FR
 heptyl cinnamateFL/FR
 hexanal diethyl acetalFL/FR
(E)-2-hexen-1-yl phenyl acetateFL/FR
 hyacinth absoluteFL/FR
 linalyl phenyl acetateFL/FR
(E)-para-methoxycinnamaldehydeFL/FR
 methyl (E)-2-hexenoateFL/FR
 methyl hydrocinnamateFL/FR
 methyl ortho-anisateFL/FR
alpha-naphthyl methyl ketoneFL/FR
(E,E)-2,6-alloocimeneFL/FR
 octyl isovalerateFL/FR
 phenethyl furoateFL/FR
 phenethyl lactateFL/FR
 phenyl acetaldehyde 2,3-butylene glycol acetalFL/FR
 phenyl acetaldehyde solutionFL/FR
(S)-2-phenyl propionaldehydeFL/FR
2-phenyl propyl acetateFL/FR
(R)-2-phenyl propyl alcoholFL/FR
3-phenyl propyl formateFL/FR
3-phenyl propyl propionateFL/FR
 propyl anthranilateFL/FR
isopropyl anthranilateFL/FR
 propyl pyruvateFL/FR
 santalyl phenyl acetateFL/FR
 surfleurs d'oranger oilFL/FR
alpha-terpinyl anthranilateFL/FR
 undecanal propylene glycol acetalFL/FR
beta-damasconeFL/FR
anisic
para-anisyl phenyl acetateFL/FR
ortho-methyl acetophenoneFL/FR
aromatic
 hyacinth acetalsFL/FR
 leafy acetalFL/FR
brown
 beeswax absoluteFL/FR
chemical
 styralyl alcoholFL/FR
citrus
 citronellyl oxyacetaldehydeFL/FR
(Z)-4-decenalFL/FR
 petitgrain bigarade oilFL/FR
dairy
 methyl butyl phenyl acetateFL/FR
floral
isoamyl phenyl acetateFL/FR
 cardamom absoluteFL/FR
 citronellyl phenyl acetateFL/FR
 cocoa pentenalFL/FR
 geranyl phenyl acetateFL/FR
 linalyl anthranilateFL/FR
 methyl phenyl acetateFL/FR
beta-naphthyl methyl ketoneFL/FR
 neroli oil bigardeFL/FR
 neroli oil CO2 extractFL/FR
bitter orangeflower absolute moroccoFL/FR
 phenethyl anthranilateFL/FR
 phenethyl benzoateFL/FR
 phenethyl propionateFL/FR
 phenyl acetic acidFL/FR
 rose absolute (rosa centifolia) moroccoFL/FR
 tuberose absolute (from concrete)FL/FR
 tuberose absolute (from pommade)FL/FR
fruity
 allyl phenoxyacetateFL/FR
para-anisyl alcoholFL/FR
 benzyl methyl etherFL/FR
isobutyl anthranilateFL/FR
 cyclohexyl anthranilateFL/FR
(Z)-beta-damasconeFL/FR
(E)-beta-damasconeFL/FR
 ethyl anthranilateFL/FR
2-heptanolFL/FR
 methyl anthranilateFL/FR
 nerolin fragarolFL/FR
(Z)-3-octen-1-yl propionateFL/FR
 osmanthus flower absoluteFL/FR
2-phenyl propionaldehyde dimethyl acetalFL/FR
 strawberry glycidate 1 (aldehyde C-16 (so-called))FL/FR
 strawberry glycidate 2FL/FR
green
 acetaldehyde ethyl phenethyl acetalFL/FR
 cinnamyl alcoholFL/FR
 cocoa butenalFL/FR
 green etherFL/FR
 immortelle absoluteFL/FR
 nerol oxideFL/FR
 phenethyl formateFL/FR
2-phenyl propionaldehydeFL/FR
2-phenyl propyl alcoholFL/FR
2-phenyl-2-pentenalFL/FR
herbal
 matricaria chamomilla flower oilFL/FR
honey
 allyl phenyl acetateFL/FR
 butyl phenyl acetateFL/FR
 ethyl phenyl acetateFL/FR
 phenethyl acetateFL/FR
 phenethyl phenyl acetateFL/FR
 phenyl acetaldehydeFL/FR
 propyl phenyl acetateFL/FR
isopropyl phenyl acetateFL/FR
medicinal,
 phenethyl salicylateFL/FR
naphthyl
beta-naphthyl methyl etherFL/FR
phenolic
para-cresyl phenyl acetateFL/FR
 guaiacyl phenyl acetateFL/FR
 phenyl pyruvic acidFL/FR
powdery
beta-naphthyl ethyl etherFL/FR
soapy
1-dodecanolFL/FR
spicy
isoeugenyl phenyl acetateFL/FR
3-phenyl propyl alcoholFL/FR
sweet
 cyclohexyl acetic acidFL/FR
waxy
(Z,Z)-3,6-nonadien-1-olFL/FR
(Z)-6-nonen-1-olFL/FR
 phenethyl hexanoateFL/FR
 rhodinyl phenyl acetateFL/FR
woody
alpha-terpinyl methyl etherFL/FR
 
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Potential Uses:
 honeyFR
 hyacinthFR
 neroliFR
 orange blossomFR
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 bigaflor
(E)-2-phenyl propenyl acetate
(E)-2-phenyl-1(2)-propene-1-yl acetate
(1E)-2-phenylprop-1-en-1-yl acetate
(1E)-2-phenylprop-1-enyl acetate
[(E)-2-phenylprop-1-enyl] acetate
(E)-2-phenylpropenyl acetate
1-propen-1-ol, 2-phenyl-, acetate, (1E)-
1-propen-1-ol, 2-phenyl-, acetate, (E)-
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