sandal glycol acetal
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :2-cyclohexyl-2,5,5-trimethyl-1,3-dioxane
InChI :InChI=1/C13H18O2/c1-12(2)9-14-13(3,15-10-12)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
InChIKey :AALXTPRRKXUUOM-UHFFFAOYAM
SMILES :CC1(COC(OC1)(C)C2=CC=CC=C2)C
(EINECS) number :226-466-7
cas number :5406-58-6
molar refractivity :60.03 ± 0.3 cm3
parachor :509.5 ± 4.0 cm3
index of refraction :1.484 ± 0.02
surface tension :34.9 ± 3.0 dyne/cm
density :0.984 ± 0.06 g/cm3
polarizability :23.80 ± 0.5 10-24cm3
xlogp : 2.70
molecular weight : 206.2808200
formula :C13 H18 O2
BioActivity Analysis :72988
 
 
export tariff code :unspecified
fda reg :unspecified
 
 

organoleptics :
odor type :woody
odor strength :medium
odor description :
at 100.00 %.  
woody sandalwood camphor methyl acetophenone sweet
substantivity :49 hour(s) at 100.00 %

properties :
appearence :colorless clear liquid
assay : 97.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.08400 - 1.09300 @ 20.00 °C.
pounds per gallon - calc. : 9.030 to 9.105
refractive index :1.43000 - 1.43500 @ 20.00 °C.
boiling point : 63.00 - 65.00 °C. @ 3.00 mm Hg
logp : 3.48

safety :
most important hazard(s) : Xi - Irritant
  
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) :> 200.00  °F.  TCC  ( > 93.33 °C. )
  
recommendation for sandal glycol acetal usage levels up to :
  5.0000 % in the fragrance concentrate.
  
recommendation for sandal glycol acetal usage levels up to :
 not for flavor use.
  

safety links :
(EINECS) number :226-466-7
chemidplus :005406586
epa-srs :5406-58-6
dtp/nci :7039
  

other :
 

references :
pubchem :656415
NIST Chemistry WebBook :1990159391
  
synonyms :
 acetoketal
 acetophenone neopentyl glycol acetal
 sandal glycol acetal
2,5,5-trimethyl-2-phenyl-1,3-dioxane
2,5,5-trimethyl-2-phenyl-meta-dioxane
soluble in :
 alcohol
 water, slightly
insoluble in :
 water
stability :
 antiperspirant
 detergent
 fabric softener
 soap
(odor and/or flavor) blends with :
 amber carbinol
 ambrette seed oil
 ambroxan
isoamyl benzoate
isoamyl salicylate
 amyris wood oil
 angelica root oil
 animal carbolactone
para-anisaldehyde
para-anisyl alcohol
 beeswax absolute
 benzoin resinoid
 benzyl salicylate
 bergamot oil
 bois de rose oil
isobornyl acetate
laevo-bornyl acetate
 boronia absolute
isobutyl cinnamate
isobutyl quinoline
 caraway seed oil
 carrot seed oil
 cassia bark oil
 cassie absolute
 castoreum absolute
 cedarwood oils
 cinnamyl acetate
 cinnamyl alcohol
 citronellol
 citronellyl formate
 clary sage oil
 clove bud oil
 clover nitrile
 copaiba balsam oil
 coriander seed oil
 costus root oil
 costus valerolactone
 coumarin
para-cresyl caprylate
 currant bud absolute black
 cyclamen aldehyde
 cyclohexyl ethyl alcohol
gamma-decalactone
 decanol
9-decen-1-ol
 dihydrojasmone
 dimethyl anthranilate
 dimethyl benzyl carbinol
 dimethyl benzyl carbinyl acetate
 dimethyl benzyl carbinyl butyrate
 dimethyl benzyl carbinyl isobutyrate
 dimethyl hydroquinone
 dodecanal
 dodecanol
 elecampane absolute
 ethyl cinnamate
 ethyl laurate
 ethyl maltol
 ethyl phenyl acetate
 ethyl vanillin
 eugenol
 fir balsam absolute
 fir needle oil
 floral pyranol
 frankincense oil
 galbanum oil
 gardenia oxide
 geraniol
 geranium oil
 ginger root oil
 grapefruit pentanol
 green acetate
 guaiacwood oil
 gurjun balsam oil
 hay absolute
 heliotropin
 heliotropyl acetate
 heliotropyl acetone
 heliotropyl diethyl acetal
gamma-heptalactone
gamma-hexalactone
(Z)-3-hexen-1-yl benzoate
(Z)-3-hexen-1-yl salicylate
alpha-hexyl cinnamaldehyde
 hyacinth ether
 hydroxycitronellal
 ionones
 juniperberry oil
 labdanum resinoid
 lavender absolute
 leaf acetal
 leerall
 lilac pentanol
 linalool
laevo-linalool
 linalool oxide
 linalyl acetate
 mace oil
 machilus oil
 marine pyridine
 melon nonenoate
 methyl acetophenone
 methyl benzoate
 methyl cedryl ketone
alpha-methyl cinnamaldehyde
 methyl cinnamate
 methyl dihydrojasmonate
 methyl ionones
 methyl isoeugenol
 methyl octine carbonate
 mimosa absolute
 muguet carboxaldehyde
 musks
 myrrh oil
beta-naphthyl ethyl ether
 nerol
 nutmeg oil
 oakmoss absolute
 ocean propanal
gamma-octalactone
 olibanum oil
 opoponax oil
 orange oil
 orris absolute
 orris pyridine
 patchouli ethanone
 patchouli oil
 peony alcohol
 peru balsam oil
 phenethyl acetate
 phenethyl alcohol
 phenethyl isobutyrate
 phenethyl phenyl acetate
 phenethyl propionate
 phenethyl salicylate
 phenyl acetaldehyde dimethyl acetal
3-phenyl propionaldehyde
3-phenyl propyl alcohol
 raspberry ketone
 raspberry ketone acetate
 raspberry ketone methyl ether
 rhodinol
 rose absolute
 rose butanoate
 rose carboxylate
 spearmint oil
 strawberry furanone
 tangerine oil
alpha-terpineol
 tetrahydrolinalool
 tetrahydromyrcenol
 tobacco dodecane
 tolu balsam
para-tolyl aldehyde
 tonka bean absolute
 tuberose absolute
gamma-undecalactone
 undecanol
10-undecen-1-al
 vanilla absolute
 vanillyl acetate
 verymoss
 vetiver oil
 violet leaf absolute
 violet methyl carbonate
 woody acetate
 woody amylene
 woody propanol
(odor and/or flavor) used in :
 acacia
 almond
 amber
 ambreine
 amyris
 animal
 apple blossom
 apple crabapple
 azalea
 balsam
 bayberry
 beeswax cire d'abeille
 blue grass
 botanical
 bouquet
 broom genet genista
 burberry
 calamus
 carnation dianthus oeillet
 cassia
 cassia blossom
 castoreum
 cedar forest
 cedarleaf
 cherry blossom
 clean
 cloth clean cloths
 clove blossom
 clover trefle le'trefle incarnat
 coconut
 coronilla
 crabapple blossom
 daffodil narcissus
 dahlia
 daisy
 daphne
 fagonia
 fantasy blends
 fern fougere
 fir balsam
 fir needle
 floral
 flouve
 foliage
 forest
 frangipanni plumeria
 freesia
 gardenia
 ginger white ginger
 grass sweet grass
 habuba
 hawthorn
 hay new mown hay foin coupe
 heather
 herbal
 hibiscus
 hollyberry
 honeysuckle chevrefeuille
 hyacinth jacinthe
 immortelle helichrysum everlasting
 incense
 jasmin
 jonquil narcissus jonquilla
 kiwi blossom
 labdanum
 lavender
 leaf autumn leaf
 leather
 lilac lilas syringa
 lily
 linden blossom limeflower tilleul
 lotus
 magnolia
 mango blossom
 meadow
 moss
 muguet lily of the valley
 musk
 myrrh
 new car
 ocean sea
 orange blossom fleur d'oranger
 orchid
 oriental
 pansy
 patchouli
 peach blossom
 pear blossom
 peony
 pine
 pinon cone
 plum blossom
 poppy
 potpourri
 powder
 rain
 rain spring rain
 redwood
 rose
 rose moss rose
 rose tea rose
 rose white rose
 sage
 sandalwood
 soapy
 spice
 stock evening scented stock
 sweet pea pois de senteur
 tobacco tabac tabaco
 tropical
 vetiver
 warm
 woodruff asperula
 woody
natural occurrence in :
not found in nature



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