melon acetal
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 :4-methyl-2-(1-phenylethyl)-1,3-dioxolane
InChI :InChI=1/C12H16O2/c1-9-8-13-12(14-9)10(2)11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3
InChIKey :KHLVXMUGPANNQD-UHFFFAOYAZ
SMILES :CC1COC(O1)C(C)C2=CC=CC=C2
cas number :67634-23-5
(EINECS) number :266-828-1
fema number :4595
molar refractivity :55.55 ± 0.3 cm3
parachor :458.2 ± 4.0 cm3
index of refraction :1.508 ± 0.02
surface tension :36.5 ± 3.0 dyne/cm
density :1.031 ± 0.06 g/cm3
polarizability :22.02 ± 0.5 10-24cm3
XlogP : 2.40
XlogP3-AA : 2.60
molecular weight : 192.2542400 (IUPAC)
formula :C12 H16 O2
BioActivity Analysis :95040
NMR Predictor :Predict
 
 
export tariff code :2911.00.5000
fda reg :unspecified
Suppliers :
Inoue :HYDRATROP ALDEHYDE PG ACETAL
organoleptics :
odor type :green
odor strength :medium
odor description:
at 100.00 %.  		green mushroom chicken coup new mown hay
Luebke, William tgsc, (1985)
odor sample from :Synarome Corporation
substantivity :132  Hour(s)
properties :
appearence :colorless to pale yellow clear liquid
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.02700 to 1.03500 @ 25.00 °C.
pounds per gallon - calc. : 8.546 to 8.612
refractive index :1.50300 to 1.50700 @ 20.00 °C.
boiling point : 256.00 to 257.00 °C. @ 760.00 mm Hg
flash point : 237.00  °F.  TCC  ( 113.89 °C. )
logP (o/w) : 2.30
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 :flavor and fragrance agents
 
recommendation for melon acetal fragrance usage levels up to :
  2.0000 % 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 : --
beverages(nonalcoholic) : 0.010000.05000
beverages(alcoholic) : --
breakfast cereal : --
cheese : --
chewing gum : --
condiments / relishes : 0.100001.00000
confectionery froastings : 0.010000.05000
egg products : --
fats / oils : --
fish products : --
frozen dairy : --
fruit ices : --
gelatins / puddings : --
granulated sugar : --
gravies : --
hard candy : --
imitation dairy : 0.100001.00000
instant coffee / tea : --
jams / jellies : --
meat products : --
milk products : --
nut products : --
other grains : --
poultry : --
processed fruits : --
processed vegetables : --
reconstituted vegetables : --
seasonings / flavors : --
snack foods : 0.100000.50000
soft candy : 0.100000.50000
soups : --
sugar substitutes : --
sweet sauces : --
safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 
4-methyl-2-(1-phenylethyl)-1,3-dioxolane
(EINECS) number :266-828-1
chemidplus :067634235
EPA Substance Registry Services :67634-23-5
dtp/nci :39434
references :
 
4-methyl-2-(1-phenylethyl)-1,3-dioxolane
pubchem :199022
Cosmetics :
Cosmetic uses : perfuming agents
other :
CosIng :cosmetic data
FDA Everything Added to Food in the United States (EAFUS)View
synonyms :
 agrestol
 cyclotropal
 hydratropaldehyde propylene glycol acetal
 hydratropaldehyde propyleneglycol acetal
 hydratropic aldehyde propylene glycol acetal
 hydratropyl aldehyde propylene glycol acetal
 melon acetal
2-(alpha-methyl benzyl)-4-methyl-1,3-dioxolane
4-methyl-2-phenyl ethyl-1,3-dioxolane
4-methyl-2-(1-phenyl ethyl)-1,3-dioxolane
4-methyl-2-(1-phenylethyl)-1,3-dioxolane
4-methyl-2-(alpha-methyl benzyl)-1,3-dioxolane
2-phenyl propanal propylene glycol acetal
2-phenyl propionaldehyde propylene glycol acetal
2-phenylpropanal propyleneglycol acetal
 vertelon
soluble in :
 alcohol
 water, 362 mg/L @ 25C
insoluble in :
 water
stability :
 alkalis
potential blenders :    note
 acetoinFL/FR
 acetoxymethyl isolongifoleneFR
 acetyl ethyl carbinolFL
 allyl nonanoateFL/FR
 amber carbinolFR
 amyl benzoateFL/FR
6-amyl-alpha-pyroneFL/FR
 benzyl methyl sulfideFL
(E)-benzyl tiglateFL/FR
 berry furanoneFL/FR
 bornyl formateFL/FR
 buchu leaf oilFL/FR
isobutyl acetoacetateFL/FR
 butyl angelateFL/FR
 butyl lactateFL/FR
 butyl laevo-lactateFL/FR
2-sec-butyl-3-methoxypyrazineFL/FR
isobutyraldehyde propylene glycol acetalFL
 carrot seed oilFL/FR
 caryophyllene alcoholFL/FR
beta-caryophyllene alcohol acetateFL/FR
 celery ketoneFL/FR
 cinnamyl isovalerateFL/FR
 cognac oil whiteFL/FR
 cuminaldehydeFL/FR
(E,E)-2,4-decadien-1-alFL
(E)-2-decen-1-alFL/FR
(Z)-7-decen-1-alFR
2-decen-1-olFL
9-decenoic acidFL/FR
 decyl acetateFL/FR
 dehydrolinaloolFL/FR
 dewy propionateFR
 dibenzyl etherFL/FR
 diethyl dimethyl-2-cyclohexenoneFR
 diethyl sebacateFL/FR
3,5-diethyl-2-methyl pyrazineFL
 dihydro-alpha-iononeFL/FR
 dihydrolinaloolFL/FR
 dihydroxyacetophenoneFL
 dimethyl dihydrocyclopentapyrazineFL
 dimethyl iononeFR
2,3-dimethyl quinoxalineFL
 dimethyl sulfoxideFL
6,8-dimethyl-2-nonanolFR
delta-2-dodecenolactoneFL/FR
 earthy acetalFL/FR
 ethyl (E)-2-hexenoateFL/FR
2-ethyl furanFL
 ethyl laurateFL/FR
 ethyl myristateFL/FR
3-ethyl pyridineFL/FR
5-ethyl-2-methyl pyridineFL
2-ethyl-3-methoxypyrazineFL/FR
2-ethyl-4,5-dimethyl oxazoleFL
2-ethyl-6-methyl pyrazineFL
 formoxymethyl isolongifoleneFR
 geranium absoluteFL/FR
 geranyl acetoacetateFL/FR
 green heptenalFR
 heptanal cyclic acetal with glycerolFL/FR
 heptanal glyceryl acetalFL/FR
(Z)-3-hepten-1-olFL/FR
3-heptyl dihydro-5-methyl-2(3H)-furanoneFL/FR
 heptyl octanoateFL/FR
 herbal ketoneFR
 hexanal butane-2,3-diol acetalFL
 hexanal octane-1,3-diol acetalFL
 hexanal propylene glycol acetalFL/FR
3-hexen-1-alFL/FR
(E)-3-hexen-1-olFL/FR
(E)-4-hexen-1-olFL
(Z)-4-hexen-1-olFL/FR
(Z)-3-hexen-1-yl (Z)-3-hexenoateFL/FR
(Z)-3-hexen-1-yl 2-methyl-2-pentenoateFR
(Z)-3-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl lactateFL/FR
(Z)-3-hexen-1-yl methyl carbonateFL/FR
(Z)-3-hexen-1-yl phenyl acetateFL/FR
(Z)-3-hexen-1-yl pyruvateFL/FR
(Z)-3-hexen-1-yl tiglateFL/FR
 hexyl 2-methyl-3-pentenoateFL/FR
 hotrienolFL/FR
5-hydroxymethyl furfuralFL
 hydroxymethyl hexyl ethyl ketoneFL/FR
beta-ionyl acetateFL/FR
 leaf acetalFL/FR
 linalyl octanoateFL/FR
 massoia lactoneFL
 meaty dithianeFL
 melon acetalFL/FR
 melon nonenoateFL/FR
3-mercaptohexyl butyrateFL
 methionalFL
 methoxycitronellalFR
 methyl 10-undecenalFL/FR
 methyl 2-(methyl thio) butyrateFL
 methyl 2-furoateFL/FR
 methyl 2-thiofuroateFL
 methyl 2-undecynoateFL
2-methyl butyl isovalerateFL/FR
 methyl cyclocitroneFR
S-methyl methioninium chloride 
 methyl octenoateFL/FR
 methyl octine carbonateFL/FR
 methyl propyl trisulfideFL
1-methyl thio-2-propanoneFL
2-methyl thio-3,5 or 6-methyl pyrazineFL/FR
4-(methyl thio) butanolFL
tris(methyl thio) methaneFL
1-(methyl thio)-2-butanoneFL
 methyl thiol isovalerateFL
 methyl undecylenateFL/FR
2-methyl-1-methyl thio-2-buteneFL
2-methyl-3-buten-2-olFL/FR
bis(2-methyl-3-furyl) disulfideFL
2-methyl-4-phenyl butanalFL/FR
 muscogeneFR
(E,E)-2,4-nonadien-1-alFL
(E,E)-2,6-nonadien-1-alFL/FR
(E,Z)-2,6-nonadien-1-alFL/FR
2,4-nonadien-1-alFL
(E,Z)-2,6-nonadien-1-al diethyl acetalFL/FR
(E,Z)-2,6-nonadien-1-olFL/FR
(E,Z)-3,6-nonadien-1-olFL/FR
(Z,Z)-3,6-nonadien-1-olFL/FR
2,4-nonadien-1-olFL/FR
2,6-nonadien-1-olFL/FR
3,6-nonadien-1-olFL/FR
(E,Z)-3,6-nonadien-1-yl acetateFL/FR
3,6-nonadien-1-yl acetateFL/FR
 nonanalFL/FR
2-nonanoneFL/FR
2,4,6-nonatrien-1-alFL
(E)-2-nonen-1-alFL/FR
(Z)-2-nonen-1-alCS
(Z)-6-nonen-1-alFL/FR
(E)-2-nonen-1-olFL/FR
(Z)-2-nonen-1-olFL/FR
(Z)-3-nonen-1-olFL/FR
(Z)-6-nonen-1-olFL/FR
(Z)-6-nonen-1-yl acetateFL/FR
1-nonen-3-olFL/FR
 nonyl acetateFL/FR
 oakmoss absoluteFL/FR
 ocean propanalFL/FR
(E,E)-2,4-octadien-1-alFL
gamma-octalactoneFL/FR
1,8-octane dithiolFL
2-octanolFL/FR
3-octanolFL/FR
3-octanoneFL/FR
(E)-2-octen-1-alFL/FR
2-octen-1-alFL/FR
(Z)-3-octen-1-olFL/FR
(Z)-5-octen-1-olFL/FR
2-octen-1-olFL/FR
(E)-2-octen-1-yl acetateFL/FR
(Z)-5-octen-1-yl propionateFL/FR
3-octen-2-olFL/FR
3-octen-2-oneFL/FR
1-octen-3-olFL/FR
1-octen-3-oneFL/FR
1-octen-3-yl butyrateFL/FR
2-octen-4-oneFL/FR
(E)-2-octenoic acidFL
 octyl 2-furoateFL
 octyl acetateFL/FR
isooctyl acetateFL/FR
 octyl phenyl acetateFL/FR
 octyl propionateFL/FR
 orris root concreteFL/FR
 orris root resinoidFL/FR
(E)-2-penten-1-ol 
2-pentyl furanFL/FR
 phenethyl butyl etherFR
 phenethyl butyrateFL/FR
 phenethyl furoateFL/FR
 phenethyl octanoateFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
2-phenyl propionaldehyde dimethyl acetalFL/FR
2-phenyl propionaldehyde ethylene glycol acetalFR
1-phenyl-2-pentanolFL/FR
 pineapple hydroxyhexanoateFL/FR
 potato butanoneFL
2-propenyl-para-cymeneFR
 propyl 2-furoateFL
 propyl 2,4-decadienoateFL/FR
 propyl isobutyrateFL/FR
isopropyl quinolineFR
 propyl salicylateFR
isopropyl tiglateFL/FR
2-isopropyl-3-(methyl thio) pyrazineFL
 roasted butanolFL
 sulfuryl acetateFL
 tetrahydrogeranyl acetoneFL/FR
 tobacco butenalFR
 tonka undecanoneFR
 tropical indeneFR
 tropical iononeFL/FR
 tropical thiazoleFL/FR
 turmeric oleoresinFL
 undecanolFL/FR
2-undecanolFL/FR
 valerian root oilFL/FR
 vanilla carboxylateFL/FR
 vanillic acidFL/FR
 vanillylidene acetoneFL/FR
 vetiver oilFL/FR
 vinyl sulfurolFL
 violet leaf absoluteFL/FR
 watermelon ketoneFR
 waxy undecadienolFR
 woody hepteneFR
potential uses :
 bean
 dairy
 diffusion
 earth humus
 fermented
 fir
 fruit tropical fruit
 fungus
 honeysuckle chevrefeuille
 melon
 mushroom
 natural
 outdoors fresh outdoors
 pumpkin
 root
 truffle
 yeast
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