phenethyl butyl ether
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IUPAC name :2-butoxyethylbenzene
InChI :InChI=1/C12H18O/c1-2-3-10-13-11-9-12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3
InChIKey :KLJOZKBZXLRMLU-UHFFFAOYAO
SMILES :CCCCOCCC1=CC=CC=C1
cas number :5331-14-6
(EINECS) number :226-226-1
molar refractivity :56.07 ± 0.3 cm3
parachor :462.6 ± 4.0 cm3
index of refraction :1.488 ± 0.02
surface tension :31.9 ± 3.0 dyne/cm
density :0.915 ± 0.06 g/cm3
polarizability :22.23 ± 0.5 10-24cm3
XlogP : 3.20
molecular weight : 178.2707200 (IUPAC)
formula :C12 H18 O
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified
Suppliers :
Vigon :CRESSANTHER
Odor:  SPICE GREEN NOTE OF CRESS
organoleptics :
odor type :floral
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description¹ :
at 10.00 % in dipropylene glycol.  		watercress mushroom gardenia green metallic
odor sample from :PPF Norda, Inc
substantivity :16  Hour(s)
properties :
appearence :colorless clear liquid
assay : 94.00 to 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 234.00 to 235.00 °C. @ 760.00 mm Hg
flash point : 207.00  °F.  TCC  ( 97.22 °C. )
logP (o/w) : 3.74
safety :
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 37/39 - Wear suitable gloves and eye/face protection.
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 
safety in use :
 
recommendation for phenethyl butyl ether fragrance usage levels up to :
  2.0000 % in the fragrance concentrate.
recommendation for phenethyl butyl ether flavor usage levels up to :
 not for flavor use.
safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 
2-butoxyethylbenzene
(EINECS) number :226-226-1
chemidplus :005331146
EPA Substance Registry Services :5331-14-6
dtp/nci :2252
references :
 
2-butoxyethylbenzene
pubchem :656257
Cosmetics :
Cosmetic uses : perfuming agents
other :
reference : Luebke, William tgsc, (1985)¹
CosIng :cosmetic data
synonyms :
2-butoxyethyl benzene
(2-butoxyethyl) benzene
2-butoxyethylbenzene
 butyl phenyl ethyl ether
 cressanther
 phenethyl butyl ether
 phenyl ethyl butyl ether
soluble in :
 alcohol
insoluble in :
 water
potential blenders :
 acetaldehyde ethyl phenethyl acetalFL/FR
2-acetyl furanFL/FR
 allyl amyl glycolateFR
 allyl cyclohexyl propionateFL/FR
 allyl hexanoateFL/FR
 almond oilFL/FR
 amber carbinolFR
isoamyl acetateFL/FR
isoamyl benzoateFL/FR
isoamyl salicylateFL/FR
 angelica root oilFL/FR
para-anisyl acetateFL/FR
 benzaldehydeFL/FR
 benzyl acetateFL/FR
 benzyl alcoholFL/FR
 benzyl benzoateFL/FR
 benzyl isobutyrateFL/FR
 benzyl propionateFL/FR
 benzyl salicylateFL/FR
 bergamot oilFL/FR
 blood orange oilFL/FR
 bois de rose oilFL/FR
isobornyl acetateFL/FR
laevo-bornyl acetateFL/FR
isobutyl salicylateFL/FR
 carrot seed oilFL/FR
 cedarleaf oilFL/FR
 cedarwood oils 
 chamomile oilFL/FR
 cinnamyl alcoholFL/FR
 citralFL/FR
 citronella oils 
 citronellyl acetateFL/FR
 citrus carbaldehydeFR
 clary sage oilFL/FR
 clover nitrileFR
 coriander seed oilFL/FR
 cyclamen aldehydeFL/FR
 cyclohexyl ethyl alcoholFL/FR
 decanalFL/FR
9-decen-1-alFL/FR
 diethyl malonateFL/FR
 dimethyl benzyl carbinolFL/FR
 dimethyl octandiol 
 ethyl cinnamateFL/FR
 ethyl laurateFL/FR
 eucalyptus oilFL/FR
 fir needle oilFL/FR
 floral pyranolFR
 frankincense oilFL/FR
 galbanum oilFL/FR
 gardenia oxideFR
 geraniolFL/FR
 geranyl acetateFL/FR
 grapefruit oilFL/FR
 grapefruit pentanolFR
 green acetateFR
 heliotropyl diethyl acetalFL/FR
 herbal undecanoneFR
(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
(Z)-3-hexen-1-yl tiglateFL/FR
 hexyl 2-methyl butyrateFL/FR
 hexyl acetateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hexyl tiglateFL/FR
 ho leaf oilFL/FR
 hyacinth etherFR
 ionones 
 juniper berry oilFL/FR
 lavender absoluteFL/FR
 leaf acetalFL/FR
 leerallFR
 lemon oilFL/FR
 lemongrass oilFL/FR
 lime oilFL/FR
 linaloolFL/FR
laevo-linaloolFL/FR
 linalool oxideFL/FR
 linalyl acetateFL/FR
 litsea cubeba oilFL/FR
 marine pyridineFR
 melon heptenalFL/FR
 melon nonenoateFL/FR
 methyl 2-methyl valerateFL/FR
 methyl benzoateFL/FR
 methyl dihydrojasmonateFL/FR
 methyl heptenoneFL/FR
2-methyl undecanalFL/FR
 methyl undecylenateFL/FR
 mimosa absoluteFL/FR
 muguet carboxaldehydeFR
 muguet octadienolFR
 nerolFL/FR
 nerolidolFL/FR
 neryl acetateFL/FR
(E,Z)-2,6-nonadien-1-alFL/FR
(E,Z)-2,6-nonadien-1-olFL/FR
 nonanalFL/FR
 nopyl acetateFR
 ocean propanalFL/FR
 octanalFL/FR
 orange oilFL/FR
 orris pyridineFL/FR
 patchouli ethanoneFR
 peony alcoholFR
 petitgrain oilFL/FR
 phenethyl acetateFL/FR
 phenethyl alcoholFL/FR
 phenyl acetaldehydeFL/FR
3-phenyl propionaldehydeFL/FR
 rhodinolFL/FR
 rose butanoateFL/FR
 spruce oilFL/FR
 strawberry glycidate 1FL/FR
 styralyl acetateFL/FR
alpha-terpineolFL/FR
alpha-terpinyl acetateFL/FR
 tetrahydrolinaloolFL/FR
 tetrahydromyrcenolFR
gamma-undecalactoneFL/FR
10-undecen-1-alFL/FR
 vetiver oilFL/FR
 violet leaf absoluteFL/FR
 violet methyl carbonateFR
 watermelon ketoneFR
 waxy aldehydeFR
 woody acetateFR
 woody amyleneFR
 woody propanolFR
potential uses :
 agate
 agrumen
 aldehydic
 alpine bouquet
 amaryllis
 apple crabapple
 ash mountain ash
 balsam
 bark
 bean
 bergamot
 blossom tropical blossom
 boxwood
 boxwood blossom
 broom genet genista
 cajuput
 calamus
 cedar forest
 celery
 cherry wild cherry
 chrysanthemum chrysantheme
 chypre
 cilantro
 citrus
 clematis
 cloudberry bakeapple
 cognac
 cologne
 cortex
 cranberry
 daffodil narcissus
 enhancer
 ethereal
 evergreen
 fantasy blends
 fern fougere
 fig
 fir balsam
 fir needle
 floral
 flouve
 foliage
 gardenia
 ginger white ginger
 green
 heather
 herbal
 hyacinth jacinthe
 hydrangea
 ivy leaf
 jonquil narcissus jonquilla
 kewda
 leaf autumn leaf
 lemon
 lemongrass
 lime
 lotus
 meadow
 metallic
 millefleurs
 mint
 mushroom
 narcissus narcisse
 nut
 ocean sea
 orchid
 orris iris
 outdoors fresh outdoors
 pansy
 pear prickly pear
 peony
 pepper tabasco pepper
 petitgrain lime petitgrain
 petunia
 pineapple
 privet
 privet blossom
 rain
 reseda mignonette
 rhubarb
 rose wild rose
 saffron
 tea
 tomato
 topnotes
 tulip
 verbena verveine
 vine
 watercress nasturtium
 weedy
 yew
natural occurrence in :
 not found in nature  



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