EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

sandal glycol acetal
acetoketal (Takasago)

Sponsors

Name:2-cyclohexyl-2,5,5-trimethyl-1,3-dioxane
CAS Number: 5406-58-6Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:226-466-7
FDA UNII:2P1XRA5CRY
Nikkaji Web:J135.012I
XlogP3-AA:2.70 (est)
Molecular Weight:206.28486000
Formula:C13 H18 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
Category:fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.08400 to 1.09300 @ 25.00 °C.
Pounds per Gallon - (est).: 9.020 to 9.095
Refractive Index:1.43000 to 1.43500 @ 20.00 °C.
Boiling Point: 63.00 to 65.00 °C. @ 3.00 mm Hg
Vapor Pressure:0.009000 mm/Hg @ 25.00 °C. (est)
Flash Point:> 200.00 °F. TCC ( > 93.33 °C. )
logP (o/w): 3.039 (est)
Soluble in:
 alcohol
 water, slightly
 water, 21.04 mg/L @ 25 °C (est)
Insoluble in:
 water
Stability:
 antiperspirant
 detergent
 fabric softener
 soap
 
Organoleptic Properties:
Odor Type: woody
Odor Strength:medium
Substantivity:49 hour(s) at 100.00 %
woody sandalwood camphoreous hawthorn sweet
Odor Description:at 100.00 %. woody sandalwood camphor methyl acetophenone sweet
Luebke, William tgsc, (1988)
Odor sample from: Takasago International Corp
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
BOC Sciences
For experimental / research use only.
Acetophenone neopentyl glycol
Inoue Perfumery
ACETOPHENONE NEOPENTYL GLYCOL ACETAL
Penta International
ACETOKETAL
 
Safety Information:
European information :
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.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: fragrance agents
Recommendation for sandal glycol acetal usage levels up to:
  5.0000 % in the fragrance concentrate.
 
Recommendation for sandal glycol acetal flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):5406-58-6
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :79409
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
2-cyclohexyl-2,5,5-trimethyl-1,3-dioxane
Chemidplus:0005406586
 
References:
 2-cyclohexyl-2,5,5-trimethyl-1,3-dioxane
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:5406-58-6
Pubchem (cid):79409
Pubchem (sid):135038244
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
dodecanal (aldehyde C-12 lauric)
FL/FR
10-
undecenal (aldehyde C-11 undecylenic)
FL/FR
amber
ambroxan
FL/FR
angelica root oil
FL/FR
cistus ladaniferus resinoid
FR
animal
animal carbolactone
FR
iso
butyl quinoline
FR
costus valerolactone
FR
para-
cresyl caprylate
FL/FR
anisic
ambrette seed oil
FL/FR
para-
anisaldehyde
FL/FR
balsamic
iso
amyl benzoate
FL/FR
amyris wood oil
FL/FR
siam
benzoin resinoid
FL/FR
benzyl salicylate
FL/FR
iso
bornyl acetate
FL/FR
laevo-
bornyl acetate
FL/FR
iso
butyl cinnamate
FL/FR
cinnamyl alcohol
FL/FR
clover nitrile
FR
copaiba balsam oil
FL/FR
ethyl cinnamate
FL/FR
fir balsam absolute
FR
fir needle oil siberia
FL/FR
methyl (E)-cinnamate
FL/FR
myrrh oil
FL/FR
opoponax oil (balsamodendron kafal)
FL/FR
peru balsam oil
FL/FR
3-
phenyl propyl alcohol
FL/FR
tolu balsam
FL/FR
berry
raspberry ketone
FL/FR
raspberry ketone acetate
FL/FR
raspberry ketone methyl ether
FL/FR
caramellic
ethyl maltol
FL/FR
strawberry furanone
FL/FR
citrus
bergamot oil bergaptene reduced italy
FL/FR
grapefruit pentanol
FR
sweet
orange peel oil c.p. brazil
FL/FR
tangerine oil america
FL/FR
tetrahydromyrcenol
FR
coconut
gamma-
heptalactone
FL/FR
gamma-
octalactone
FL/FR
fatty
decanol
FL/FR
floral
iso
amyl salicylate
FL/FR
bois de rose oil brazil
FL/FR
boronia absolute
FL/FR
cassie absolute
FL/FR
citronellol
FL/FR
citronellyl formate
FL/FR
coriander seed oil
FL/FR
cyclamen aldehyde
FL/FR
cyclohexyl ethyl alcohol
FL/FR
9-
decen-1-ol
FL/FR
dihydrojasmone
FL/FR
dimethyl anthranilate
FL/FR
dimethyl benzyl carbinol
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
dimethyl benzyl carbinyl butyrate
FL/FR
ethyl phenyl acetate
FL/FR
floral pyranol
FR
gardenia oxide
FR
geraniol
FL/FR
geranium nitrile
FR
geranium oil bourbon
FL/FR
heliotropin
FL/FR
heliotropyl acetate
FL/FR
heliotropyl acetone
FL/FR
heliotropyl diethyl acetal
FR
(Z)-3-
hexen-1-yl salicylate
FL/FR
alpha-
hexyl cinnamaldehyde
FL/FR
hyacinth ether
FR
hydroxycitronellal
FL/FR
leerall
FR
lilac pentanol
FL/FR
linalool
FL/FR
laevo-
linalool
FL/FR
linalool oxide
FL/FR
para-
methyl acetophenone
FL/FR
methyl dihydrojasmonate
FL/FR
mimosa absolute france
FL/FR
muguet carboxaldehyde
FR
nerol
FL/FR
ocean propanal
FL/FR
orris pyridine 25% IPM
FR
orris rhizome absolute (iris pallida)
FL/FR
peony alcohol
FR
phenethyl acetate
FL/FR
phenethyl alcohol
FL/FR
phenethyl isobutyrate
FL/FR
phenethyl phenyl acetate
FL/FR
phenethyl propionate
FL/FR
phenethyl salicylate
FL/FR
rhodinol
FL/FR
rose absolute (rosa damascena) bulgaria
FL/FR
rose butanoate
FL/FR
rose carboxylate
FR
tetrahydrolinalool
FL/FR
tuberose absolute (from pommade)
FL/FR
violet methyl carbonate
FR
fruity
(E)-alpha-
damascone
FL/FR
(E)-beta-
damascone
FL/FR
gamma-
decalactone
FL/FR
dimethyl benzyl carbinyl isobutyrate
FR
green acetate
FR
para-
tolualdehyde
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
green
para-
dimethyl hydroquinone
FL/FR
galbanum oil
FL/FR
(Z)-3-
hexen-1-yl benzoate
FL/FR
(Z)-
leaf acetal
FL/FR
melon nonenoate
FL/FR
methyl octine carbonate
FL/FR
phenyl acetaldehyde dimethyl acetal
FL/FR
3-
phenyl propionaldehyde
FL/FR
violet leaf absolute
FL/FR
hay
beeswax absolute
FL/FR
hay absolute
FR
herbal
carum carvi fruit oil
FL/FR
clary sage oil france
FL/FR
daucus carota fruit oil
FL/FR
lavender absolute bulgaria
FL/FR
linalyl acetate
FL/FR
leathery
castoreum absolute
FL/FR
marine
marine pyridine
FR
minty
spearmint oil america
FL/FR
mossy
oakmoss absolute
FL/FR
veramoss (IFF)
FR
naphthyl
beta-
naphthyl ethyl ether
FL/FR
phenolic
methyl benzoate
FL/FR
powdery
para-
anisyl alcohol
FL/FR
spicy
cassia bark oil china
FL/FR
cinnamyl acetate
FL/FR
clove bud oil
FL/FR
black
currant bud absolute
FL/FR
eugenol
FL/FR
ginger root oil china
FL/FR
mace oil
FL/FR
alpha-
methyl cinnamaldehyde
FL/FR
methyl isoeugenol
FL/FR
nutmeg oil
FL/FR
terpenic
frankincense oil
FL/FR
juniperus communis fruit oil
FL/FR
alpha-
terpineol
FL/FR
tonka
coumarin
FR
gamma-
hexalactone
FL/FR
tonka bean absolute
FR
vanilla
ethyl vanillin
FL/FR
vanilla bean absolute (vanilla planifolia)
FL/FR
vanillyl acetate
FL/FR
waxy
1-
dodecanol
FL/FR
ethyl laurate
FL/FR
1-
undecanol
FL/FR
woody
amber carbinol
FR
2-
decalinyl formate
FR
guaiacwood oil
FL/FR
gurjun balsam oil
FR
methyl cedryl ketone
FL/FR
patchouli ethanone
FR
patchouli oil
FL/FR
sandal pentanol
FR
sandal pentenol
FL/FR
sandel
FR
santalol
FL/FR
(+)-alpha-
santalyl acetate
FL/FR
santalyl phenyl acetate
FL/FR
tobacarol (IFF)
FR
vetiver oil haiti
FL/FR
vetiveryl formate
FR
woody acetate
FR
(Z)-
woody amylene
FR
woody propanol
FR
For Flavor
No flavor group found for these
ambrette seed oil
FL/FR
methyl (E)-cinnamate
FL/FR
rose absolute (rosa damascena) bulgaria
FL/FR
sandal pentenol
FL/FR
santalol
FL/FR
(+)-alpha-
santalyl acetate
FL/FR
santalyl phenyl acetate
FL/FR
aldehydic
aldehydic
1-
undecanol
FL/FR
animal
para-
cresyl caprylate
FL/FR
balsamic
siam
benzoin resinoid
FL/FR
benzyl salicylate
FL/FR
laevo-
bornyl acetate
FL/FR
iso
butyl cinnamate
FL/FR
copaiba balsam oil
FL/FR
ethyl cinnamate
FL/FR
fir needle oil siberia
FL/FR
myrrh oil
FL/FR
opoponax oil (balsamodendron kafal)
FL/FR
peru balsam oil
FL/FR
tolu balsam
FL/FR
berry
heliotropyl acetone
FL/FR
raspberry ketone
FL/FR
raspberry ketone acetate
FL/FR
raspberry ketone methyl ether
FL/FR
brown
beeswax absolute
FL/FR
caramellic
ethyl maltol
FL/FR
strawberry furanone
FL/FR
cherry
heliotropin
FL/FR
citrus
bergamot oil bergaptene reduced italy
FL/FR
laevo-
linalool
FL/FR
linalool
FL/FR
nerol
FL/FR
sweet
orange peel oil c.p. brazil
FL/FR
tangerine oil america
FL/FR
alpha-
terpineol
FL/FR
creamy
para-
anisaldehyde
FL/FR
gamma-
hexalactone
FL/FR
para-
methyl acetophenone
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
fatty
(Z)-3-
hexen-1-yl benzoate
FL/FR
10-
undecenal (aldehyde C-11 undecylenic)
FL/FR
floral
bois de rose oil brazil
FL/FR
citronellol
FL/FR
dihydrojasmone
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
dimethyl benzyl carbinyl butyrate
FL/FR
geraniol
FL/FR
geranium oil bourbon
FL/FR
heliotropyl acetate
FL/FR
linalyl acetate
FL/FR
methyl dihydrojasmonate
FL/FR
ocean propanal
FL/FR
phenethyl alcohol
FL/FR
phenethyl propionate
FL/FR
rhodinol
FL/FR
tetrahydrolinalool
FL/FR
tuberose absolute (from pommade)
FL/FR
fruity
iso
amyl benzoate
FL/FR
para-
anisyl alcohol
FL/FR
boronia absolute
FL/FR
citronellyl formate
FL/FR
(E)-beta-
damascone
FL/FR
(E)-alpha-
damascone
FL/FR
gamma-
decalactone
FL/FR
dimethyl anthranilate
FL/FR
lilac pentanol
FL/FR
rose butanoate
FL/FR
green
iso
amyl salicylate
FL/FR
angelica root oil
FL/FR
cinnamyl alcohol
FL/FR
cyclamen aldehyde
FL/FR
cyclohexyl ethyl alcohol
FL/FR
para-
dimethyl hydroquinone
FL/FR
galbanum oil
FL/FR
(Z)-3-
hexen-1-yl salicylate
FL/FR
(Z)-
leaf acetal
FL/FR
linalool oxide
FL/FR
melon nonenoate
FL/FR
methyl octine carbonate
FL/FR
oakmoss absolute
FL/FR
phenyl acetaldehyde dimethyl acetal
FL/FR
3-
phenyl propionaldehyde
FL/FR
violet leaf absolute
FL/FR
herbal
carum carvi fruit oil
FL/FR
clary sage oil france
FL/FR
coriander seed oil
FL/FR
daucus carota fruit oil
FL/FR
lavender absolute bulgaria
FL/FR
honey
ethyl phenyl acetate
FL/FR
phenethyl acetate
FL/FR
phenethyl isobutyrate
FL/FR
phenethyl phenyl acetate
FL/FR
lactonic
gamma-
heptalactone
FL/FR
gamma-
octalactone
FL/FR
leathery
castoreum absolute
FL/FR
medicinal
dimethyl benzyl carbinol
FL/FR
phenethyl salicylate
FL/FR
minty
spearmint oil america
FL/FR
phenolic
methyl benzoate
FL/FR
powdery
beta-
naphthyl ethyl ether
FL/FR
soapy
dodecanal (aldehyde C-12 lauric)
FL/FR
1-
dodecanol
FL/FR
spicy
cassia bark oil china
FL/FR
cassie absolute
FL/FR
cinnamyl acetate
FL/FR
clove bud oil
FL/FR
black
currant bud absolute
FL/FR
eugenol
FL/FR
ginger root oil china
FL/FR
mace oil
FL/FR
alpha-
methyl cinnamaldehyde
FL/FR
methyl isoeugenol
FL/FR
nutmeg oil
FL/FR
3-
phenyl propyl alcohol
FL/FR
para-
tolualdehyde
FL/FR
sweet
orris rhizome absolute (iris pallida)
FL/FR
terpenic
juniperus communis fruit oil
FL/FR
vanilla
ethyl vanillin
FL/FR
vanilla bean absolute (vanilla planifolia)
FL/FR
vanillyl acetate
FL/FR
waxy
decanol
FL/FR
9-
decen-1-ol
FL/FR
ethyl laurate
FL/FR
alpha-
hexyl cinnamaldehyde
FL/FR
hydroxycitronellal
FL/FR
mimosa absolute france
FL/FR
woody
ambroxan
FL/FR
amyris wood oil
FL/FR
iso
bornyl acetate
FL/FR
frankincense oil
FL/FR
guaiacwood oil
FL/FR
methyl cedryl ketone
FL/FR
patchouli oil
FL/FR
vetiver oil haiti
FL/FR
 
Potential Uses:
FRacacia
FRalmond
FRamber
FRambreine
FRamyris
FRanimal
FRapple blossom
 apple crabapple
FRautumn
FRazalea
FRbalsam
FRbayberry
FRbeeswax absolute replacer
FRblue grass
 botanical
FRbouquet
 burberry
FRcalamus oil replacer
FRcarnation
FRcassia
 cassia blossom
FRcastoreum
FRcedar
FRcedar forest
FRcherry blossom
 clean
 cloth clean cloths
 clove blossom
FRclover
FRcoconut
FRcoronilla
FRcountry meadow
FRcrabapple blossom
FRdaffodil
 dahlia
FRdaisy
FRdaphne
FRfagonia
 fantasy blends
FRfern
FRfir balsam
FRfir needle oil replacer
FRfloral
FRflouve
 foliage
FRforest
FRfrangipani plumeria
FRfreesia
FRgardenia
FRgenet
FRginger white ginger
FRhabuba
FRhawthorn
FRhay new mown hay
FRheather
FRherbal
FRhibiscus
FRhollyberry
FRhoneysuckle
FRhyacinth
FL/FRimmortelle
FRincense
FRjasmin
FRjonquil
 kiwi blossom
FRlabdanum
FRlavender
FRleather
FRlilac
FRlily
FRlily of the valley
FRlinden flower
FRlotus
FRmagnolia
FRmango flower
FRmoss
FRmusk
FRmyrrh
 new car
 ocean sea
FRorange blossom
FRorchid
FRoriental
FRpansy
FRpatchouli
FRpeach blossom
FRpear blossom
FRpeony
FRpine
FRpinion
 plum blossom
 poppy
FRpotpourri
FRpowder
FRrain
 redwood
FRrose
FRrose moss rose
FRrose tea rose
FRrose white rose
FRsage
FRsandalwood
FRscented stock
FRsoapy sandalwood moss
FRspice
FRspring rain
FRsweet grass
FRsweet pea
FRtobacco
FLtropical
FRvetiver
 warm
FRwoodruff
FRwoody
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 acetoketal (Takasago)
 acetophenone neopentyl glycol acetal
2-cyclohexyl-2,5,5-trimethyl-1,3-dioxane
1,3-dioxane, 2,5,5-trimethyl-2-phenyl-
m-dioxane, 2,5,5-trimethyl-2-phenyl-
 sandal glycol acetal
2,5,5-trimethyl-2-phenyl-1,3-dioxane
2,5,5-trimethyl-2-phenyl-m-dioxane
2,5,5-trimethyl-2-phenyl-meta-dioxane
 

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