tea acetate
Suppliers  organoleptics  properties  safety  references  cosmetics    FEMA Index    Home Page
 
Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here.
 
IUPAC name :(3-methyl-1-phenylpentan-3-yl) acetate
InChI :InChI=1/C14H20O2/c1-4-14(3,16-12(2)15)11-10-13-8-6-5-7-9-13/h5-9H,4,10-11H2,1-3H3
InChIKey :HIWRBTFSEFIZNE-UHFFFAOYAR
SMILES :CCC(C)(CCC1=CC=CC=C1)OC(=O)C
cas number :72007-81-9
(EINECS) number :276-282-6
beilstein number :3260573
molar refractivity :65.33 ± 0.3 cm3
parachor :542.4 ± 4.0 cm3
index of refraction :1.493 ± 0.02
surface tension :33.8 ± 3.0 dyne/cm
density :0.979 ± 0.06 g/cm3
polarizability :25.90 ± 0.5 10-24cm3
XlogP : 3.70
molecular weight : 220.3074000 (IUPAC)
formula :C14 H20 O2
NMR Predictor :Predict
 
 
export tariff code :2915.39.9050
fda reg :unspecified
Suppliers :
Inoue :1-Ethyl-1-methyl-3-phenyl propyl acetate
organoleptics :
odor type :floral
odor strength :medium
odor description:
at 100.00 %.  		fresh floral hyacinth tea sweet fruity narcissus
properties :
appearence :colorless clear liquid
assay : 96.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.97500 to 0.98300 @ 25.00 °C.
pounds per gallon - calc. : 8.113 to 8.180
specific gravity :0.97600 to 0.98400 @ 20.00 °C.
pounds per gallon - calc. : 8.131 to 8.197
refractive index :1.48700 to 1.49200 @ 20.00 °C.
boiling point : 303.00 to 304.00 °C. @ 760.00 mm Hg
flash point :> 212.00  °F.  TCC  ( > 100.00 °C. )
logP (o/w) : 4.10
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 36 - Wear suitable protective clothing.
Oral Toxicity(LD50) : 
  Not determined
Dermal Toxicity(LD50) : 
  Not determined
Inhalation Toxicity(LC50) : 
  Not determined
 
safety in use :
Category :fragrance agents
 
recommendation for tea acetate fragrance usage levels up to :
  10.0000 % in the fragrance concentrate.
recommendation for tea acetate 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
 
 
 
 
(3-methyl-1-phenylpentan-3-yl) acetate
(EINECS) number :276-282-6
chemidplus :072007819
EPA Substance Registry Services :72007-81-9
references :
 
(3-methyl-1-phenylpentan-3-yl) acetate
pubchem :737526
Cosmetics :
Cosmetic uses : perfuming agents
other :
CosIng :cosmetic data
synonyms :
1-ethyl-1-methyl-3-phenyl propyl acetate
alpha-ethyl-alpha-methyl benzene propanol acetate
 methyl ethyl phenyl ethyl carbinyl acetate
(3-methyl-1-phenylpentan-3-yl) acetate
 phenethyl methyl ethyl carbinyl acetate
 phenyl ethyl methyl ethyl carbinyl acetate
1-phenyl-3-methyl-3-pentanyl acetate
 tea acetate
soluble in :
 alcohol
insoluble in :
 water
potential blenders :    note
 acetal 318FR
 acetaldehyde ethyl phenethyl acetalFL/FR
6-acetoxydihydrotheaspiraneFL/FR
1-acetyl cyclohexyl acetateFL
isoamyl 3-(2-furan) propionateFL/FR
 amyl angelateFL
isoamyl angelateFL/FR
alpha-amyl cinnamaldehydeFL/FR
para-anisyl alcoholFL/FR
para-anisyl formateFL/FR
 basil oleoresin sweetFL/FR
 benzaldehyde / methyl anthranilate schiff's baseFR
 benzaldehyde propylene glycol acetalFL/FR
 benzyl acetateFL/FR
 benzyl acetoacetateFL/FR
 benzyl cinnamateFL/FR
 benzyl formateFL/FR
 benzyl methyl etherFL/FR
 berry hexanoateFR
isobutyl anthranilateFL/FR
isobutyl furyl propionateFL/FR
2-butyl thiopheneFL
 butyl undecylenateFL/FR
 chamomile isobutyrateFR
 chamomile propionateFR
 chamomile valerateFR
 champaca absoluteFR
 champaca flower oilFR
 cinnamyl alcoholFL/FR
 cinnamyl formateFL/FR
 citronellyl butyrateFL/FR
 citronellyl hexanoateFL/FR
 citronellyl isobutyrateFL/FR
 citronellyl propionateFL/FR
(E)-citronellyl tiglateFL/FR
 citrus carbaldehyde / methyl anthranilate schiff's baseFR
 clary propyl acetateFR
 clary sage absoluteFL/FR
 clary sage oilFL/FR
para-cresolFL/FR
para-cresyl acetateFL/FR
para-cresyl isobutyrateFL/FR
para-cresyl phenyl acetateFL/FR
para-cresyl phenyl ether 
(-)-cubenol 
(E)-beta-damasconeFL/FR
(Z)-beta-damasconeFL/FR
beta-damasconeFL/FR
2-decalinyl acetateFR
2,4-difurfuryl furanFL
 dihydrojasmoneFL/FR
 dimethyl benzyl carbinyl acetateFL/FR
 dimethyl benzyl carbinyl propionateFR
 dimethyl salicylateFL/FR
2,4-dimethyl thiazoleFL
S-(2,5-dimethyl-3-furyl) ethane thioateFL
(E+Z)-4,8-dimethyl-3,7-nonadien-2-oneFL
 ethyl 2-furoateFL
 ethyl hydrocinnamateFL/FR
 ethyl levulinateFL/FR
4-ethyl octanoic acidFL/FR
 galbanum ketoneFR
 genet absoluteFL/FR
 geraniolFL/FR
 geranyl formateFL/FR
 green etherFL/FR
 guaiacyl phenyl acetateFL/FR
(-)-guaiolFR
 guaiyl acetateFL/FR
2-heptanolFL/FR
 heptyl butyrateFL/FR
 heptyl cinnamateFL/FR
 heptyl isobutyrateFL/FR
 hexanal diethyl acetalFL/FR
(Z)-3-hexen-1-yl isovalerateFL/FR
 hexoxyacetaldehyde dimethyl acetalFR
2-hexyl-4-acetoxytetrahydrofuranFL
 hyacinth absoluteFL/FR
 hyacinth butanalFR
 hyacinth etherFR
2,4-ivy carbaldehyde / methyl anthranilate schiff's baseFR
 kewda absolute 
 kewda oil 
 leafy acetalFL/FR
 lilac pentanolFL/FR
 lily absoluteFR
 lime pyranFR
 magnolia indeneFR
 mate absoluteFL/FR
 menthadienyl formateFR
 menthyl acetateFL/FR
dextro,laevo-menthyl acetateFL/FR
3-mercaptohexyl acetateFL
ortho-methoxybenzyl ethyl etherFR
 methoxymelonalFR
 methyl (Z)-3-hexenoateFL/FR
 methyl 4-phenyl butyrateFL
 methyl alpha-iononeFL/FR
 methyl benzyl acetate (mixed ortho-,meta-,para-)FL/FR
 methyl cyclogeranateFR
 methyl decanoateFL/FR
alpha-isomethyl ionone (90% min.)FL/FR
 methyl ionyl acetateFL/FR
 methyl isobutyrateFL/FR
(E)-7-methyl-3-octen-2-oneFL
 muguet undecadienalFR
 narcissus acetateFL/FR
3-nonanon-1-yl acetateFL/FR
 orris root concreteFL/FR
 petitgrain lemon oilFL/FR
 phenethyl formateFL/FR
 phenethyl isobutyrateFL/FR
 phenethyl isovalerateFL/FR
 phenethyl salicylateFL/FR
 phenoxyacetaldehyde 50% in benzyl alcoholFR
 phenyl acetaldehyde / methyl anthranilate schiff's baseFR
 phenyl acetaldehyde ethylene glycol acetalFR
 phenyl glycol diacetateFR
2-phenyl propionaldehydeFL/FR
2-phenyl propionaldehyde dimethyl acetalFL/FR
2-phenyl propyl acetateFL/FR
(R)-2-phenyl propyl alcoholFL/FR
2-phenyl propyl alcoholFL/FR
3-phenyl propyl alcoholFL/FR
1-phenyl propyl butyrateFL/FR
3-phenyl propyl formateFL/FR
2-phenyl propyl isobutyrateFL/FR
 phenyl propyl phenyl acetateFL/FR
3-phenyl propyl propionateFL/FR
(E)-2-phenyl-1(2)-propene-1-yl acetateFR
4-phenyl-3-buten-2-olFL/FR
2-phenyl-4-pentenalFL
ketoisophoroneFL/FR
isoprenyl acetateFL/FR
isopropyl benzoateFL/FR
 reseda acetalFR
 rhubarb pyranFR
 rose undeceneFR
 saffron indenoneFL/FR
 saffron oilFL/FR
 saffron pyranoneFR
1-oxaspiro-4,7-dodecaneFR
 star fruit oil cubaFL/FR
 styralyl alcoholFL/FR
 terpinyl valerateFL/FR
 tetrahydroionyl acetateFR
 tetrahydrolinaloolFL/FR
 tetrahydromyrcenolFR
 theaspiraneFL/FR
4-(para-tolyl)-2-butanoneFL/FR
 tropical iononeFL/FR
 verbena absolute franceFL
 wallflower absoluteFR
potential uses :
 chypre
 floral
 hyacinth jacinthe
 narcissus narcisse
 oriental
 tea
natural occurrence in :    note
 not found in nature  

information only - not sold by The Good Scents Company.


Please share your Information / Comments.

Your email Address:


Top of Page          The Good Scents Company Home
Copyright © 1980-2010 The Good Scents Company Disclaimer Privacy Policy
Html Last modified 02/21/2010