allyl amyl glycolate
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Notes :
Adds a modern sparkle to any Fragrance.
 
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IUPAC name :prop-2-enyl 2-(3-methylbutoxy)acetate
InChI :InChI=1/C10H18O3/c1-4-6-13-10(11)8-12-7-5-9(2)3/h4,9H,1,5-8H2,2-3H3
InChIKey :XCWPXUNHSPOFGV-UHFFFAOYAP
SMILES :CC(C)CCOCC(=O)OCC=C
cas number :67634-00-8
(EINECS) number :266-803-5
molar refractivity :51.58 ± 0.3 cm3
parachor :460.7 ± 4.0 cm3
index of refraction :1.431 ± 0.02
surface tension :28.7 ± 3.0 dyne/cm
density :0.936 ± 0.06 g/cm3
polarizability :20.44 ± 0.5 10-24cm3
XlogP : 2.20
XlogP3-AA : 2.30
molecular weight : 186.2481200 (IUPAC)
formula :C10 H18 O3
BioActivity Analysis :17389497
NMR Predictor :Predict
 
 
IUPAC name :prop-2-enyl 2-(2-methylbutoxy)acetate
InChI :InChI=1/C10H18O3/c1-4-6-13-10(11)8-12-7-9(3)5-2/h4,9H,1,5-8H2,2-3H3
InChIKey :GWFJURKHPPFFMD-UHFFFAOYAI
SMILES :CCC(C)COCC(=O)OCC=C
cas number :67634-01-9
(EINECS) number :266-804-0
molar refractivity :51.58 ± 0.3 cm3
parachor :460.7 ± 4.0 cm3
index of refraction :1.431 ± 0.02
surface tension :28.7 ± 3.0 dyne/cm
density :0.936 ± 0.06 g/cm3
polarizability :20.44 ± 0.5 10-24cm3
XlogP : 2.00
XlogP3-AA : 2.30
molecular weight : 186.2481200 (IUPAC)
formula :C10 H18 O3
NMR Predictor :Predict
 
 
export tariff code :2918.90.3500
fda reg :unspecified
Suppliers :
Berje :Allyl Amyl Glycolate
Citrus and Allied Essences :Allyl Amyl Glycolate
Fleurchem :allyl amyl glycolate
IFF :Allyl Amyl Glycolate
≥98% (sum of isomers)
Odor:  Fruity, Green, Pineapple
Strong, Fruity, galbanum with a pineapple modification. Adds a modern sparkle to any Fragrance
Inoue :ALLYL ISOAMYLOXY ACETATE
John D. Walsh :Allyl Amyl Glycolate
Odor:  Fruity pineapple note, with aspects of apple and galbanum
Moellhausen :allyl amyl glycolate
90% min. artifical kosher
Organica Aromatics :ALLYL AMYL GLYCOLATE
Min 97% (sum of isomers)
Odor:  Strong, fruity, pineapple note with green galbanum nuances.
It can be used to reinforce modern green and oriental fragrances with its strength and tenacity.
Penta :allyl amyl glycolate
Polarome :ALLYL AMYL GLYCOLATE
SAFC Global® :Allyl isoamyl glycolate
≥98%
organoleptics :
odor type :fruity
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description:
at 10.00 % in dipropylene glycol.  		fruity green galbanum pineapple fusel
Luebke, William tgsc, (2000)
odor sample from :CA Aromatics Company Inc.
substantivity :84  Hour(s)
properties :
appearence :colorless clear liquid
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.93500 to 0.94300 @ 25.00 °C.
pounds per gallon - calc. : 7.780 to 7.847
specific gravity :0.93600 to 0.94400 @ 20.00 °C.
pounds per gallon - calc. : 7.798 to 7.864
refractive index :1.42800 to 1.43300 @ 20.00 °C.
boiling point : 201.00 to 203.00 °C. @ 760.00 mm Hg
vapor density :>1 ( Air = 1 )
flash point :> 200.00  °F.  TCC  ( > 93.33 °C. )
logP (o/w) : 2.72
shelf life : 24.00 month(s) or longer if stored properly.
storage :store in cool, dry place in tightly sealed containers, protected from heat and light.
safety :
most important hazard(s) :Xn - Harmful.
  R 22 - Harmful if swallowed.
R 26/27/28 - Very toxic by inhalation, in contact with skin and if swallowed.
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 36/37/39 - Wear suitable clothing, gloves and eye/face protection.
S 46 - If swallowed, seek medical advice immediately and show this container or label.
Oral Toxicity(LD50) : 
  Not determined
Dermal Toxicity(LD50) : 
  Not determined
Inhalation Toxicity(LC50) : 
  Not determined
 
safety in use :
Category :fragrance agents
 
IFRA purity specification :< 0.1% free allyl alcohol
recommendation for allyl amyl glycolate fragrance usage levels up to :
  2.0000 % in the fragrance concentrate.
recommendation for allyl amyl glycolate flavor usage levels up to :
 not for flavor use.
safety references :
msds :msds
EPI System :view
IFRA :IFRA - ( Found under : Allyl esters )
National Toxicology Program :Search
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
SCCNFP :opinion
 
WGK Germany :2
 
 
 
 
prop-2-enyl 2-(3-methylbutoxy)acetate
(EINECS) number :266-803-5
chemidplus :067634008
EPA/NOAA CAMEO :hazardous materials
EPA Substance Registry Services :67634-00-8
 
 
 
prop-2-enyl 2-(2-methylbutoxy)acetate
(EINECS) number :266-804-0
chemidplus :067634019
EPA Substance Registry Services :67634-01-9
references :
 
prop-2-enyl 2-(3-methylbutoxy)acetate
pubchem :683955
 
prop-2-enyl 2-(2-methylbutoxy)acetate
pubchem :683956
Cosmetics :
Cosmetic uses : masking agents
perfuming agents
other :
CosIng :cosmetic data
 C of A
FMA :listed
synonyms :
 allyl (3-methyl butoxy) acetate
 allyl amyl glycolate
 allyl isoamyl glycolate
 allyl isoamyl oxyacetate
isoamyl allyl glycolate
isoamyl oxyacetic acid allyl ester
 galbanum glycolate
 glycolic acid 2-pentoxyallyl ester
 prop-2-enyl 2-(3-methylbutoxy)acetate
2-propen-1-yl (3-methyl butoxy) acetate
2-propenyl (3-methyl butoxy) acetate
2-propenyl 2-((3-methyl butyl)oxy) ethanoate
soluble in :
 alcohol
insoluble in :
 water
stability :
 antiperspirant
 deo stick
 detergent perborate
 fabric softener
 hard surface cleaner
 shampoo
 soap
potential blenders :    note
isoamyl butyrateFL/FR
alpha-amyl cinnamaldehydeFL/FR
isoamyl isovalerateFL/FR
para-anisaldehydeFL/FR
 benzoin resinoidFL/FR
 benzyl acetateFL/FR
 bergamot oilFL/FR
 blood orange oilFL/FR
 caramel furanoneFL
 cardamom seed oilFL/FR
 citralFL/FR
 coriander seed oilFL/FR
 cyclamen aldehydeFL/FR
gamma-decalactoneFL/FR
 decanolFL/FR
 diethyl malonateFL/FR
 dihydrojasmoneFL/FR
 dihydromyrcenolFL/FR
 dimethyl anthranilateFL/FR
 dimethyl benzyl carbinyl acetateFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 dodecanalFL/FR
 ethyl acetoacetateFL/FR
 ethyl cinnamateFL/FR
 ethyl heptanoateFL/FR
 floral pyranolFR
 galbanum oilFL/FR
 galbanum oxyacetateFR
 geraniolFL/FR
 green acetateFR
 heliotropyl acetoneFL/FR
(Z)-3-hexen-1-olFL/FR
(Z)-3-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
 hexyl 2-methyl butyrateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
2,4-ivy carbaldehydeFL/FR
 leerallFR
 linaloolFL/FR
laevo-linaloolFL/FR
 linalool oxideFL/FR
 melon heptenalFL/FR
 methyl dihydrojasmonateFL/FR
2-methyl undecanalFL/FR
 musks 
beta-naphthyl ethyl etherFL/FR
 nerolidolFL/FR
(E,Z)-2,6-nonadien-1-olFL/FR
 nonanolFL/FR
 ocean propanalFL/FR
 orange oilFL/FR
 osmanthus absoluteFL/FR
 phenethyl isovalerateFL/FR
 phenethyl propionateFL/FR
 raspberry ketone acetateFL/FR
 rose butanoateFL/FR
 rose oxides 
 santallFR
 styralyl acetateFL/FR
alpha-terpineolFL/FR
alpha-terpinyl acetateFL/FR
 tetrahydrolinaloolFL/FR
para-tolyl aldehydeFL/FR
gamma-undecalactoneFL/FR
 violet leaf absoluteFL/FR
 watermelon ketoneFR
 ylang ylang oilFL/FR
potential uses :
 alliage
 apple
 apple red apple
 apricot
 blueberry whortleberry red whortleberry
 bouquet
 bramble arctic bramble
 chamomile
 christmas blends
 chypre
 cloudberry bakeapple
 coconut tropical coconut
 cool water
 drakkar
 eternity
 fern fougere
 fig
 floral
 fruit
 fruit jam
 fruit juicy fruit
 fruit punch
 fruit tropical fruit
 galbanum
 green
 herbal
 honeysuckle chevrefeuille
 jasmin
 lavender
 lilac lilas syringa
 mango
 melon watermelon muskmelon cantaloupe
 papaya
 passion fruit
 pina colada
 pineapple
 plum greengage plum
 plum mirabelle plum
 pomegranate
 quince
 raspberry
 rose
 spice
 strawberry
 tomato
 tresor
 tropical
 tutti frutti
natural occurrence in :    note
 not found in nature  


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