phenoxyethanol
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IUPAC name :2-phenoxyethanol
InChI :InChI=1/C8H10O2/c9-6-7-10-8-4-2-1-3-5-8/h1-5,9H,6-7H2
InChIKey :QCDWFXQBSFUVSP-UH
SMILES :C1=CC=C(C=C1)OCCO
cas number :122-99-6
(EINECS) number :204-589-7
eu annex :603-098-00-9
beilstein number :1364011
fema number :4620
molar refractivity :39.09 ± 0.3 cm3
parachor :320.4 ± 4.0 cm3
index of refraction :1.525 ± 0.02
surface tension :39.9 ± 3.0 dyne/cm
density :1.084 ± 0.06 g/cm3
polarizability :15.50 ± 0.5 10-24cm3
XlogP : 1.20
XlogP3 : 1.20
molecular weight : 138.1638000 (IUPAC)
formula :C8 H10 O2
BioActivity Analysis :68596
pherobase :view
NMR Predictor :Predict
 
 
export tariff code :2909.49.0000
fda reg :unspecified
Suppliers :
Berje :Phenoxy Ethanol
(Rose Ether)
John D. Walsh :Phenoxy Ethanol
Moellhausen :phenoxyethyl alcohol
99% min. nature identical kosher
Penta :phenoxyethanol
Sigma-Aldrich-Fluka :2-Phenoxyethanol
≥99.0%
Symrise :Phenoxyethyl alcohol
Odor:  weak, mild, rosy, balsamic, cinnamon-like
Vigon :Phenoxy Ethanol Extra
98%
Odor:  MILD ROSY, METALLIC
Vigon :Phenoxy Ethanol Rose Ether
organoleptics :
odor type :floral
odor strength :medium
odor description¹ :
at 100.00 %.  		mild rose balsam cinnamyl
odor sample from :Emery Chemicals
substantivity :84  Hour(s)
properties :
appearence :colorless oily liquid to solid
assay : 99.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.10500 to 1.10800 @ 25.00 °C.
pounds per gallon - calc. : 9.195 to 9.220
refractive index :1.53700 to 1.54000 @ 20.00 °C.
melting point : 12.00 to 14.00 °C. @ 760.00 mm Hg
boiling point : 237.00 to 238.00 °C. @ 760.00 mm Hg
boiling point : 153.00 to 154.00 °C. @ 50.00 mm Hg
vapor pressure :0.00700 mm/Hg @ 25.00 °C.
flash point : 250.00  °F.  TCC  ( 121.11 °C. )
logP (o/w) : 1.16
safety :
most important hazard(s) :Xn - Harmful.
  R 22 - Harmful if swallowed.
R 36 - Irritating to eyes.
S 02 - Keep out of the reach of children.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 37 - Wear suitable gloves.
Oral Toxicity(LD50) :
  Oral-Rat    1260.00  mg/kg
Journal of Industrial Hygiene and Toxicology. Vol. 23, Pg. 259, 1941.

Intraperitoneal-Mouse    490.00  mg/kg
Toksikologicheskii Vestnik. Vol. (3), Pg. 37, 1996.

Oral-Mouse    933.00  mg/kg
Toksikologicheskii Vestnik. Vol. (3), Pg. 37, 1996.

Intraperitoneal-Rat    554.00  mg/kg
Toksikologicheskii Vestnik. Vol. (3), Pg. 37, 1996.

Dermal Toxicity(LD50) :
  Skin-Rabbit  5.00  ml/kg
Union Carbide Data Sheet. Vol. 6/24/1958

Skin-Rat  14422.00  mg/kg
Journal of the American College of Toxicology. Vol. 9, Pg. 259, 1990.

Inhalation Toxicity(LC50) :
  Not determined
 
safety in use :
 
recommendation for phenoxyethanol fragrance usage levels up to :
  5.0000 % in the fragrance concentrate.
 
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 on the "LIBRARY" link.
publication number : 24
 average usual ppmaverage maximum ppm
baked goods : 4.000008.00000
beverages(nonalcoholic) : 0.500002.00000
beverages(alcoholic) : 1.000003.00000
breakfast cereal : --
cheese : --
chewing gum : --
condiments / relishes : --
confectionery froastings : --
egg products : --
fats / oils : --
fish products : --
frozen dairy : 2.000005.00000
fruit ices : 1.000002.00000
gelatins / puddings : 1.000003.00000
granulated sugar : --
gravies : --
hard candy : 1.000005.00000
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 : 1.000005.00000
soups : --
sugar substitutes : --
sweet sauces : --
safety references :
EPI System :view
NIOSH International Chemical Safety Cards :search
NLM Hazardous Substances Data Bank :search
AIDS Citations :Search
Cancer Citations :Search
Toxicology Citations :Search
Env. Mutagen Info. Center :Search
NLM Developmental and Reproductive Toxicity :Search
National Toxicology Program :Search
EPA Chem. Sub. Inventory : Yes
SCCNFP :opinion
 
WGK Germany :1
 
 
 
 
2-phenoxyethanol
(EINECS) number :204-589-7
RTECS :122-99-6
chemidplus :000122996
EPA/NOAA CAMEO :hazardous materials
EPA Substance Registry Services :122-99-6
dtp/nci :1864
references :
 
2-phenoxyethanol
NIST Chemistry WebBook :3848789196
pubchem :173272
Cosmetics :
Cosmetic uses : preservatives
other :
reference : Luebke, William tgsc, (1987)¹
CosIng :cosmetic data
VCF-Online: VCF Volatile Compounds in Food
RIFM :listed
FMA :listed
Household Products : Search
synonyms :
 1160 rose ether
 arosol
 emeressence 1160 rose ether
 ethylene glycol monophenyl ether
 ethylene glycol phenyl ether
 glycol monophenyl ether
1-hydroxy-2-phenoxyethane
2-hydroxyethyl phenyl ether
beta-hydroxyethyl phenyl ether
2-(phenoxy)ethanol
2-phenoxyethanol
beta-phenoxyethanol
 phenoxyethyl alcohol
 phenoxytol
 phenyl cellosolve
 phenyl monoglycol ether
 rose ether
 rose ether 1160
soluble in :
 alcohol
 paraffin oil, slightly soluble
 water, 26700 mg/L @ 20C
insoluble in :
 water
potential blenders :
 acetaldehyde ethyl phenethyl acetalFL/FR
 allyl amyl glycolateFR
 allyl cyclohexyl propionateFL/FR
isoamyl benzoateFL/FR
alpha-amyl cinnamaldehydeFL/FR
isoamyl phenyl acetateFL/FR
isoamyl salicylateFL/FR
 amyris wood oilFR
para-anisaldehydeFL/FR
para-anisyl acetateFL/FR
para-anisyl alcoholFL/FR
 atractylis absoluteFR
 benzoin resinoidFL/FR
 benzophenoneFL/FR
 benzyl acetateFL/FR
 benzyl alcoholFL/FR
 benzyl cinnamateFL/FR
 benzyl isobutyrateFL/FR
 benzyl isoeugenolFL/FR
 benzyl propionateFL/FR
 benzyl salicylateFL/FR
 bergamot oilFL/FR
 blood orange oilFL/FR
 bois de rose oilFL/FR
isobutyl cinnamateFL/FR
isobutyl quinolineFR
isobutyl salicylateFL/FR
 carnation absoluteFR
 cinnamyl alcoholFL/FR
 citralFL/FR
 citronellalFL/FR
 citronellolFL/FR
 citronellyl acetateFL/FR
 clary sage oilFL/FR
 clove bud oilFL/FR
 clover nitrileFR
 coriander seed oilFL/FR
 coumarinFR
para-cresyl acetateFL/FR
para-cresyl caprylateFL/FR
para-cresyl phenyl acetateFL/FR
 cyclamen aldehydeFL/FR
 cyclohexyl ethyl alcoholFL/FR
alpha-damasconeFL/FR
beta-damasconeFL/FR
 decanalFL/FR
9-decen-1-alFL/FR
9-decen-1-olFL/FR
 dihydrojasmoneFL/FR
 dimethyl anthranilateFL/FR
 dimethyl benzyl carbinolFL/FR
 dimethyl benzyl carbinyl acetateFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 dimethyl hydroquinoneFL/FR
 diphenyl oxideFL/FR
 ethyl cinnamateFL/FR
 ethyl laurateFL/FR
 ethyl maltolFL/FR
 ethyl phenyl acetateFL/FR
 ethyl vanillinFL/FR
 eugenolFL/FR
isoeugenyl acetateFL/FR
 fir balsam absoluteFL/FR
 floral pyranolFR
 gardenia oxideFR
 geraniolFL/FR
 geranium oilFL/FR
 geranyl acetateFL/FR
(E)-geranyl acetoneFL/FR
 green acetateFR
 hay absoluteFR
 heliotropinFL/FR
 heliotropyl acetoneFL/FR
(Z)-3-hexen-1-olFL/FR
(Z)-3-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl benzoateFL/FR
(Z)-3-hexen-1-yl formateFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hexyl tiglateFL/FR
 ho leaf oilFL/FR
 hyacinth etherFR
 hydroxycitronellalFL/FR
 immortelle absoluteFL/FR
 indoleFL/FR
 ionones 
 jasmin absoluteFL/FR
 karo-karounde absoluteFR
 labdanum resinoidFR
 lavender absoluteFL/FR
 leaf acetalFL/FR
 leerallFR
 lemon oilFL/FR
 lilyallFR
 linaloolFL/FR
laevo-linaloolFL/FR
 linalool oxideFL/FR
 linalyl acetateFL/FR
 maltolFL/FR
 melon nonenoateFL/FR
 methyl acetophenoneFL/FR
para-methyl anisoleFL/FR
 methyl anthranilateFL/FR
 methyl cedryl ketoneFL/FR
 methyl cinnamateFL/FR
 methyl dihydrojasmonateFL/FR
 methyl heptine carbonateFL/FR
 methyl ionones 
 methyl isoeugenolFL/FR
 methyl octine carbonateFL/FR
 methyl phenyl acetateFL/FR
 mimosa absoluteFL/FR
 muguet carboxaldehydeFR
 muguet octadienolFR
 musks 
beta-naphthyl ethyl etherFL/FR
beta-naphthyl methyl etherFL/FR
 narcissus absoluteFR
 nerolFL/FR
 nerolidolFL/FR
 neryl acetateFL/FR
 nonanalFL/FR
 nonanolFL/FR
 oakmoss absoluteFL/FR
 ocean propanalFL/FR
 orange oilFL/FR
 orangeflower absoluteFL/FR
 orris absoluteFL/FR
 orris pyridineFL/FR
 patchouli ethanoneFR
 patchouli oilFL/FR
 peony alcoholFR
 pepper oil blackFL/FR
 phenethyl acetateFL/FR
 phenethyl isobutyrateFL/FR
 phenethyl isovalerateFL/FR
 phenethyl phenyl acetateFL/FR
 phenethyl propionateFL/FR
 phenethyl salicylateFL/FR
 phenyl acetaldehydeFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
 phenyl acetic acidFL/FR
3-phenyl propionaldehydeFL/FR
3-phenyl propyl alcoholFL/FR
 raspberry ketoneFL/FR
 raspberry ketone acetateFL/FR
 raspberry ketone methyl etherFL/FR
 rhodinolFL/FR
 rose absoluteFL/FR
 rose butanoateFL/FR
 rose oxides 
 sandalwood oilFL/FR
 santallFR
 strawberry glycidate 1FL/FR
 styralyl acetateFL/FR
alpha-terpineolFL/FR
alpha-terpinyl acetateFL/FR
 tetrahydrolinaloolFL/FR
 tetrahydromyrcenolFR
 tobacco dodecaneFR
 tonka bean absoluteFR
gamma-undecalactoneFL/FR
10-undecen-1-alFL/FR
 vanilla absoluteFL/FR
 vanillyl acetateFL/FR
 verymossFR
 vetiver oilFL/FR
 violet leaf absoluteFL/FR
 violet methyl carbonateFR
 watermelon ketoneFR
 woody acetateFR
 woody amyleneFR
 ylang ylang oilFL/FR
potential uses :
 acacia
 aldehydic
 almond
 amber
 ambrene
 angel
 antibacterial agents
 apple blossom
 apricot
 balsam
 bellodgia
 blue grass
 blue mist
 bluebell
 blueberry
 botanical
 bouquet
 broom genet genista
 carnation dianthus oeillet
 cassie acacia farnesiana
 champaca champak
 cherry
 cherry blossom
 chestnut blossom
 civet
 coconut tropical coconut
 crabapple blossom
 currant
 elderberry
 fern fougere
 fetes
 fixer
 floral
 frangipanni plumeria
 gardenia
 geranium
 ginger white ginger
 gooseberry
 hawthorn
 heather
 heliotrope
 herbal
 hibiscus
 honeysuckle chevrefeuille
 hops houblon
 hyacinth jacinthe
 jasmin
 jonquil narcissus jonquilla
 kiwi blossom
 leather
 lemon
 lilac lilas syringa
 lily
 linden blossom limeflower tilleul
 lotus
 magnolia
 meadow
 muguet lily of the valley
 mulberry
 narcissus narcisse
 neroli
 orange blossom fleur d'oranger
 orchid
 oriental
 orris iris
 peach
 peony
 potpourri
 powder
 preservatives
 quelques fleurs
 rain
 raspberry
 rose
 rose leaf
 rose red rose
 rose tea rose
 rose white rose
 sandalwood
 spice
 strawberry
 sweet pea pois de senteur
 tea black tea
 tea green tea
 tuberose tubereuse
 violet
 wallflower giroflee
 woody
 ylang ylang cananga
natural occurrence in :
 filipendula vulgaris S
 narcissus gaditanus S
 narcissus jonquilla S
 nelumbo nucifera S
data pageulva rigida oil greece @ 1.60% S



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