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

4-phenyl-3-buten-2-ol
4-phenylbut-3-en-2-ol

Sponsors

Name:4-phenylbut-3-en-2-ol
CAS Number: 17488-65-2Picture of molecule3D/inchi
Other:123536-30-1
ECHA EINECS - REACH Pre-Reg:241-501-6
FDA UNII:IIV76T367H
Beilstein Number:2040727
CoE Number:2032
XlogP3-AA:2.10 (est)
Molecular Weight:148.20484000
Formula:C10 H12 O
NMR Predictor:Predict (works with chrome or firefox)
Name:(E)-4-phenylbut-3-en-2-ol
CAS Number: 36004-04-3Picture of molecule3D/inchi
Nikkaji Web:J28.644C
XlogP3-AA:2.10 (est)
Molecular Weight:148.20484000
Formula:C10 H12 O
NMR Predictor:Predict (works with chrome or firefox)
Name:(Z)-4-phenylbut-3-en-2-ol
CAS Number: 31915-95-4Picture of molecule3D/inchi
FDA UNII:59SJ957IUM
Nikkaji Web:J474.278H
XlogP3-AA:2.10 (est)
Molecular Weight:148.20484000
Formula:C10 H12 O
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:819 4-phenyl-3-buten-2-ol
FLAVIS Number:02.066 (Old)
DG SANTE Food Flavourings:02.066 4-phenylbut-3-en-2-ol
FEMA Number:2880 4-phenyl-3-buten-2-ol
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm: 4-PHENYL-3-BUTEN-2-OL
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 oily liquid (est)
Assay: 96.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.00600 to 1.01200 @ 25.00 °C.
Pounds per Gallon - (est).: 8.371 to 8.421
Refractive Index:1.55800 to 1.56700 @ 20.00 °C.
Boiling Point: 140.00 °C. @ 12.00 mm Hg
Vapor Pressure:0.004000 mm/Hg @ 25.00 °C. (est)
Flash Point: 252.00 °F. TCC ( 122.22 °C. )
logP (o/w): 2.043 (est)
Soluble in:
 alcohol
 water, 2935 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium
sweet fruity floral balsamic
Odor Description:at 100.00 %. sweet fruity floral balsam
Flavor Type: waxy
">waxy grape floral sweet
Taste Description: at 25.00 ppm in ethyl alcohol. waxy, concord grape, floral, sweet
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
4-Phenyl-3-buten-2-ol
Parchem
4-phenyl-3-buten-2-ol
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association
 
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-rat LD50 2400 ul/kg

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for 4-phenyl-3-buten-2-ol usage levels up to:
  0.2000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 2.30 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.10 (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: -20.00000
beverages(nonalcoholic): -2.00000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -20.00000
fruit ices: -20.00000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 0.0300020.00000
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):

Scientific Opinion on Flavouring Group Evaluation 215 (FGE.215): Seven a,-Unsaturated Cinnamyl Ketones from subgroup 3.2 of FGE.19
View page or View pdf

EPI System: View
Env. Mutagen Info. Center:Search
EPA Substance Registry Services (TSCA):17488-65-2
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :15172
National Institute of Allergy and Infectious Diseases:Data
4-phenylbut-3-en-2-ol
Chemidplus:0017488652
(E)-4-phenylbut-3-en-2-ol
Chemidplus:017488652
(Z)-4-phenylbut-3-en-2-ol
Chemidplus:0031915954
 
References:
 4-phenylbut-3-en-2-ol
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:17488-65-2
Pubchem (cid):15172
Pubchem (sid):158493
Pherobase:View
 (E)-4-phenylbut-3-en-2-ol
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:36004-04-3
Pubchem (cid):5369489
Pubchem (sid):204610
 (Z)-4-phenylbut-3-en-2-ol
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:31915-95-4
Pubchem (cid):11469151
Pubchem (sid):42548086
 
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
HMDB (The Human Metabolome Database):HMDB31616
FooDB:FDB008254
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
No odor group found for these
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-one
FL/FR
aldehydic
aldehydic
3-
methyl-4-hexyl oxybutyraldehyde
FR
balsamic
iso
amyl benzoate
FL/FR
benzyl cinnamate
FL/FR
iso
butyl cinnamate
FL/FR
cinnamyl butyrate
FL/FR
(E)-
cinnamyl butyrate
FL/FR
cinnamyl formate
FL/FR
hexyl cinnamate
FR
linalyl cinnamate
FL/FR
octyl benzoate
FR
octyl cinnamate
FR
peru balsam oil
FL/FR
peru balsam resinoid
FL/FR
phenyl salicylate
FR
pine needle absolute
FL/FR
prenyl benzoate
FL/FR
iso
propyl cinnamate
FL/FR
terpinyl butyrate
FL/FR
tolu balsam absolute
FL/FR
tolu balsam resinoid
FL/FR
chocolate
cocoa pentenal
FL/FR
citrus
(R)-
citronellyl nitrile
FR
citronitrile (Symrise)
FR
2-
heptanol
FL/FR
fatty
butyl undecylenate
FL/FR
4-
ethyl octanoic acid
FL/FR
fermented
methyl decanoate
FL/FR
floral
acetal 318
FR
iso
amyl angelate
FL/FR
alpha-
amyl cinnamaldehyde
FL/FR
alpha-
amyl cinnamyl acetate
FL/FR
benzyl acetate
FL/FR
benzyl acetoacetate
FL/FR
benzyl acetone
FL/FR
benzyl alcohol
FL/FR
benzyl formate
FL/FR
benzyl isobutyrate
FL/FR
blue lagoon fragrance
FR
(S)-
citronellyl acetate
FL/FR
citronellyl acetone
FL/FR
citronellyl butyrate
FL/FR
citronellyl hexanoate
FL/FR
citronellyl phenyl acetate
FL/FR
citronellyl propionate
FL/FR
(E)-
citronellyl tiglate
FL/FR
3-
cyclohexene-1-carboxylic acid, 2,6,6-trimethyl-, methyl ester
FR
cyclohexyl salicylate
FR
cymbopogon validus leaf oil
FR
dihydrogeranyl linalool
FR
dihydrojasmone
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
3,6-
dimethyl-3-octyl acetate
FR
ethyl anthranilate
FL/FR
ethyl ethyl anthranilate
FL/FR
eucalyptus macarthurii oil
FR
floral undecenone
FR
geraniol
FL/FR
geranyl isobutyrate
FL/FR
geranyl phenyl acetate
FL/FR
hibiscus fragrance
FR
hydroxycitronellol
FL/FR
beta-
ionol
FL/FR
ionone mixed isomers
FL/FR
jasmin cyclopentanone
FR
iso
jasmone
FL/FR
linalyl butyrate
FL/FR
magnolia specialty
FR
menthadienyl formate
FR
ortho-
methoxybenzyl ethyl ether
FR
methoxymelonal
FL/FR
1-(2-
methyl allyl oxy)-3-methoxy-3-methyl-1-butane
FR
para-
methyl benzyl acetate
FL/FR
methyl benzyl acetate (mixed ortho-,meta-,para-)
FL/FR
alpha-iso
methyl ionone (90% min.)
FL/FR
methyl ionyl acetate
FL/FR
(±)-3-
methyl-gamma-decalactone
FL/FR
pink
nelumbo nucifera flower absolute
FR
white
nelumbo nucifera flower absolute
FR
white
nelumbo nucifera flower concrete
FR
3-
nonanon-1-yl acetate
FL/FR
orris rhizome concrete butter (iris pallida)
FL/FR
osmanthus absolute replacer
FR
osmanthus concrete
FL/FR
petitgrain lemon oil
FL/FR
petitgrain mandarin oil
FL/FR
phenethyl alcohol
FL/FR
phenethyl isobutyrate
FL/FR
phenethyl isovalerate
FL/FR
phenoxyethanol
FL/FR
1-
phenyl propyl alcohol
FL/FR
1-
phenyl propyl butyrate
FL/FR
2-
phenyl propyl isobutyrate
FL/FR
3-
phenyl propyl propionate
FL/FR
(Z,E)-
phytol
FL/FR
iso
propyl benzoate
FL/FR
rhodinyl butyrate
FL/FR
rose oil (rosa damascena) russia
FL/FR
rose oil (rosa damascena) turkey
FL/FR
rose undecene
FR
souroubea specialty
FR
star fruit oil cuba
FL/FR
styralyl propionate
FL/FR
terpinyl valerate
FL/FR
tetrahydroionyl acetate
FR
fruity
allyl (E)-cinnamate
FL/FR
allyl benzoate
FR
allyl cinnamate
FL/FR
apricot essence
FL/FR
balsam specialty
FR
benzaldehyde / methyl anthranilate schiff's base
FR
benzyl propionate
FL/FR
benzyl valerate
FL/FR
berry hexanoate
FR
butyl 2-naphthyl ether
FL/FR
iso
butyl anthranilate
FL/FR
iso
butyl furyl propionate
FL/FR
(E)-
cinnamyl propionate
FL/FR
citronellyl isobutyrate
FL/FR
cyclohexyl crotonate
FR
(E)-beta-
damascone
FL/FR
beta-
damascone
FL/FR
(Z)-beta-
damascone
FL/FR
(R)-gamma-
dodecalactone
FL/FR
eriocephalus punctulatus flower oil
FR
ethyl levulinate
FL/FR
ethyl methyl-para-tolyl glycidate
FL/FR
ginsene
FR
heptyl isobutyrate
FL/FR
linalool oxide acetates
FL/FR
3-
mercaptohexyl acetate
FL/FR
methyl (Z)-3-hexenoate
FL/FR
methyl bicycloheptenyl methyloxirane carboxylate
FR
methyl isobutyrate
FL/FR
(E)-7-
methyl-3-octen-2-one
FL/FR
myrascone
FR
2-
nonanone propylene glycol acetal
FL/FR
alpha-
ocimene
FL/FR
peach nitrile
FR
3-
phenyl propyl isobutyrate
FL/FR
plum damascone (high alpha)
FR
rhubarb pyran
FR
sambucus canadensis fruit absolute
FL/FR
strawberry glycidate 1 (aldehyde C-16 (so-called))
FL/FR
(R)-
styralyl acetate
FL/FR
4-(para-
tolyl)-2-butanone
FL/FR
tropical ionone
FL/FR
cis-
woody acetate
FR
green
iso
amyl 3-(2-furan) propionate
FL/FR
(Z)-3-
hexen-1-yl benzoate
FL/FR
(Z)-3-
hexen-1-yl isovalerate
FL/FR
hexoxyacetaldehyde dimethyl acetal
FR
hexyl phenyl acetate
FL/FR
magnolia flower oil CO2 extract
FL/FR
picea glauca leaf absolute
FR
1-[(3aS,7aR)-3a,4,7,7a-
tetrahydro-1H-inden-6-yl]ethanone
FR
herbal
chamomile isobutyrate
FR
chamomile propionate
FR
chamomile valerate
FR
clary propyl acetate
FR
clary sage absolute
FL/FR
geranium cyclohexane
FR
methyl cyclogeranate (Firmenich)
FR
tagete oil madagascar
FL/FR
medicinal
ortho-
cresyl acetate
FL/FR
powdery
alpha-
methyl ionone
FL/FR
(E)-alpha-
methyl ionone (74-80%)
FL/FR
spicy
para-
anisyl formate
FL/FR
(E)-
cinnamyl acetate
FL/FR
cinnamyl propionate
FL/FR
honey extract
CS
black
poplar bud absolute
FR
(E)-
propyl 2-furan acrylate
FL/FR
spicy acetoacetate
FL/FR
tobacco
honey absolute
FL/FR
tropical
triflaige A
FR
waxy
dihydrocitronellyl acetate
FL/FR
(E)-
methyl geranate
FL/FR
phytyl acetate
FL/FR
woody
2-
decalinyl acetate
FR
melozol acetate
FR
rhubarb oxirane
FR
santalyl butyrate
FL/FR
For Flavor
No flavor group found for these
1-
acetyl cyclohexyl acetate
FL
allyl (E)-cinnamate
FL/FR
allyl cinnamate
FL/FR
iso
amyl angelate
FL/FR
amyl angelate
FL
benzyl valerate
FL/FR
butyl 2-naphthyl ether
FL/FR
2-
butyl thiophene
FL
(E)-
cinnamyl acetate
FL/FR
(E)-
cinnamyl butyrate
FL/FR
(E)-
cinnamyl propionate
FL/FR
citronellyl acetone
FL/FR
ortho-
cresyl acetate
FL/FR
2,4-
difurfuryl furan
FL
dihydrocitronellyl acetate
FL/FR
S-(2,5-
dimethyl-3-furyl) ethane thioate
FL
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-one
FL/FR
(R)-gamma-
dodecalactone
FL/FR
ethyl 3-hydroxyoctanoate
FL
ethyl ethyl anthranilate
FL/FR
4-
hydroxyphenethyl alcohol
FL
ionone mixed isomers
FL/FR
linalool oxide acetates
FL/FR
magnolia flower oil CO2 extract
FL/FR
methyl benzyl acetate (mixed ortho-,meta-,para-)
FL/FR
(E)-
methyl geranate
FL/FR
(±)-3-
methyl-gamma-decalactone
FL/FR
2-
nonanone propylene glycol acetal
FL/FR
alpha-
ocimene
FL/FR
phenoxyethanol
FL/FR
1-
phenyl propyl butyrate
FL/FR
2-
phenyl propyl isobutyrate
FL/FR
3-
phenyl propyl propionate
FL/FR
phytyl acetate
FL/FR
pine needle absolute
FL/FR
prenyl benzoate
FL/FR
iso
propyl benzoate
FL/FR
santalyl butyrate
FL/FR
(R)-
styralyl acetate
FL/FR
terpinyl butyrate
FL/FR
vitispirane
FL
iso
amyl 3-(2-furan) propionate
FL/FR
benzyl acetoacetate
FL/FR
iso
butyl furyl propionate
FL/FR
beta-
damascone
FL/FR
balsamic
balsamic
iso
butyl cinnamate
FL/FR
peru balsam oil
FL/FR
peru balsam resinoid
FL/FR
1-
phenyl propyl alcohol
FL/FR
(Z,E)-
phytol
FL/FR
iso
propyl cinnamate
FL/FR
tolu balsam absolute
FL/FR
tolu balsam resinoid
FL/FR
berry
heptyl isobutyrate
FL/FR
burnt
ethyl 2-furoate
FL
citrus
petitgrain lemon oil
FL/FR
petitgrain mandarin oil
FL/FR
styralyl propionate
FL/FR
earthy
alpha-
amyl cinnamyl acetate
FL/FR
ethereal
methyl isobutyrate
FL/FR
fatty
4-
ethyl octanoic acid
FL/FR
(Z)-3-
hexen-1-yl benzoate
FL/FR
methyl decanoate
FL/FR
(E)-7-
methyl-3-octen-2-one
FL/FR
floral
cinnamyl propionate
FL/FR
(S)-
citronellyl acetate
FL/FR
citronellyl hexanoate
FL/FR
citronellyl phenyl acetate
FL/FR
citronellyl propionate
FL/FR
cocoa pentenal
FL/FR
dihydrojasmone
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
geraniol
FL/FR
geranyl isobutyrate
FL/FR
geranyl phenyl acetate
FL/FR
beta-
ionol
FL/FR
linalyl butyrate
FL/FR
2-
methyl butyl 3-methyl butenoate
FL
(E)-alpha-
methyl ionone (74-80%)
FL/FR
alpha-iso
methyl ionone (90% min.)
FL/FR
orris rhizome concrete butter (iris pallida)
FL/FR
phenethyl alcohol
FL/FR
rhodinyl butyrate
FL/FR
rose oil (rosa damascena) russia
FL/FR
rose oil (rosa damascena) turkey
FL/FR
tropical ionone
FL/FR
fruity
iso
amyl benzoate
FL/FR
apricot essence
FL/FR
benzyl acetate
FL/FR
benzyl acetone
FL/FR
benzyl alcohol
FL/FR
benzyl formate
FL/FR
benzyl isobutyrate
FL/FR
benzyl propionate
FL/FR
iso
butyl anthranilate
FL/FR
citronellyl butyrate
FL/FR
citronellyl isobutyrate
FL/FR
(E)-beta-
damascone
FL/FR
(Z)-beta-
damascone
FL/FR
ethyl anthranilate
FL/FR
ethyl levulinate
FL/FR
ethyl methyl-para-tolyl glycidate
FL/FR
2-
heptanol
FL/FR
hexyl phenyl acetate
FL/FR
2-
hexyl-4-acetoxytetrahydrofuran
FL
linalyl cinnamate
FL/FR
methoxymelonal
FL/FR
methyl (Z)-3-hexenoate
FL/FR
methyl 4-phenyl butyrate
FL
para-
methyl benzyl acetate
FL/FR
alpha-
methyl ionone
FL/FR
3-
nonanon-1-yl acetate
FL/FR
osmanthus concrete
FL/FR
phenethyl isovalerate
FL/FR
3-
phenyl propyl isobutyrate
FL/FR
2-
phenyl-4-pentenal
FL
(E)-
propyl 2-furan acrylate
FL/FR
sambucus canadensis fruit absolute
FL/FR
star fruit oil cuba
FL/FR
strawberry glycidate 1 (aldehyde C-16 (so-called))
FL/FR
tagete oil madagascar
FL/FR
terpinyl valerate
FL/FR
4-(para-
tolyl)-2-butanone
FL/FR
green
(E)-
citronellyl tiglate
FL/FR
clary sage absolute
FL/FR
(Z)-3-
hexen-1-yl isovalerate
FL/FR
iso
jasmone
FL/FR
honey
honey absolute
FL/FR
phenethyl isobutyrate
FL/FR
powdery
hydroxycitronellol
FL/FR
spicy
para-
anisyl formate
FL/FR
benzyl cinnamate
FL/FR
cinnamyl formate
FL/FR
spicy acetoacetate
FL/FR
tropical
alpha-
amyl cinnamaldehyde
FL/FR
3-
mercaptohexyl acetate
FL/FR
waxy
butyl undecylenate
FL/FR
winey
cinnamyl butyrate
FL/FR
woody
methyl ionyl acetate
FL/FR
 
Potential Uses:
FRamber
FRbalsam
 candy
FRfloral
 fruit
 grape
FRhawthorn
 waxy
 
Occurrence (nature, food, other):note
 monanthotaxis capea
Search Trop Picture
 
Synonyms:
3-buten-2-ol, 4-phenyl-
homocinnamyl alcohol
4-phenyl but-3-en-2-ol
(E)-4-phenyl qbut-3-en-2-ol
4-phenylbut-3-en-2-ol
 
 
Notes:
Used as a food additive [EAFUS] Flavouring ingredient
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